Oversætter rapport til Dansk. Engelsk vises foreløbig.

FTIR-ANALYSERAPPORT

FTIR-spektrumanalyserapport

Nr.: 20250729045546460431846 Dato: Rapporteret af: FTIR.fun Kontakt: [email protected]

Download en professionel, formateret PDF af denne analyse.

Top15

Lighedssorteret Top-15 bibliotekssammenligning

Biblioteksspektrum vises her.

Infrarødt spektrum sammenligningsdiagram Analyseresultat: Organic compound with alkene/aromatic unsaturation and hydroxy/phenolic functionalities, likely containing nitrogen.

The sample exhibits bands characteristic of unsaturated (C=C) and hydroxyl groups, together with features attributable to aliphatic C-H, aromatic or C-N vibrations, and a distinct phenolic O-H absorption. Library matching gives a weak top hit propan-2-yl nitrate (15% confidence), but the shared top‑15 chemistry points consistently to alkene/methyl compounds. The overall spectral pattern is consistent with a small organic molecule containing unsaturation and hydroxy/phenolic groups, possibly with nitrogen‑bearing functionality; a definitive structural identification is not possible with the currently available evidence

Biblioteksspektrum Interaktiv prøvekurve Flyt markøren for at vise den lodrette guide-linje.

Top-15-kandidater

Referencebibliotekskandidater

Rang	Match %	Forbindelsesnavn	Formel / SMILES	Biblioteksforhåndsvisning	Handling
Referencekandidater indlæses med denne Top-15-arbejdsbænk.

Baseret på biblioteksmatch og ovenstående beviser.

Konklusion

Organic compound with alkene/aromatic unsaturation and hydroxy/phenolic functionalities, likely containing nitrogen

LLM-konfidens

Konklusion

Direct literature evidence explicitly relates the bands at 1610, 1280, 1378, 754, 3176, and 3539 cm-1 to C=C, alkyl C-H, C-H bending, C-N, phenolic, and hydroxyl groups, respectively, in various organic and hybrid materials [1–6].
The top-15 library consensus features alkene and methyl as the dominant chemical motifs, reinforcing the unsaturated hydrocarbon character of the sample.
The band at 1610 cm-1 is assigned to a C=C double bond vibration, consistent with the explicit report of this mode by Nardi et al. (2013) for a UV‑cured polymer nanocomposite [1].

Bevis

Nøglebevis

Biblioteksledende match

propan-2-yl nitrate #370

Begrænsninger

Beviser, der begrænser konklusionen

The library top match propan-2-yl nitrate is very weak (similarity 0.0, 15% confidence), and characteristic nitrate ester bands (e.g., N-O stretch near 860 cm-1) are absent from the sample spectrum, making this specific identification unsupported.
The C-N assignment at 754 cm-1 originates from a study on mineral‑doped silica gel, and its direct relevance to an organic‑matrix sample is uncertain.
The analogical literature evidence for C-N stretching at 1280 cm-1 from cross‑linked PVA hybrid membranes is only suggestive and cannot be taken as a definitive assignment.
Many of the cited literature sources deal with materials (polymers, nanoparticles, biological extracts, mineral composites) that may differ significantly from the composition of the current sample, reducing the transferable certainty of the peak assignments.
The exact nature of the unsaturation (aliphatic C=C vs. aromatic ring) cannot be determined without additional characteristic bands, such as aromatic C-H stretches above 3000 cm-1 or ring‑breathing modes in the 1450–1600 cm-1 region.

Anbefaling

Foreslået næste verifikation

To reduce the present uncertainty, obtain a higher‑resolution spectrum, especially in the fingerprint region (400–1500 cm-1), to search for weaker but structurally indicative bands.
Complementary analysis by mass spectrometry or nuclear magnetic resonance spectroscopy is recommended to confirm the presence of nitrogen and to resolve whether the unsaturation is olefinic or aromatic.
If the sample is a known reaction product or mixture, comparison with a verified reference standard of the suspected compound would greatly improve the reliability of the peak assignments.

Topanalyse

Detekterede toppe og fortolkning

★ = Litteraturunderstøttet top-tildeling.

Har du brug for formel ordlyd og manuel gennemgang? Opgrader til gennemgået rapport

Indeks	Karakteristik	Bølgetal	Tildelingsstatus	Bevis	Enlinjefortolkning	Reference	Konfidens
1	★	1378	1.00	Litteraturunderstøttet tildeling	Båndet ved 1378 cm-1 er tildelt til C-H asymmetric + symmetric bending.	[3]	LLM-konfidens
2	★	1610	0.37	Litteraturunderstøttet tildeling	Båndet ved 1610 cm-1 er tildelt til c=c double bond.	[1]	LLM-konfidens
3	★	1280	0.29	Litteraturunderstøttet tildeling	Båndet ved 1280 cm-1 er tildelt til alkyl C-H vibration.	[6]	LLM-konfidens
4	★	3539	0.17	Analog litteraturtildeling	Båndet ved 3539 cm-1 er tildelt til O-H stretching (hydroxyl).	[8]	Samlet tillid
5	★	754	0.13	Litteraturunderstøttet tildeling	Båndet ved 754 cm-1 er tildelt til c n single bond.	[1]	-
6	★	3176	0.12	Litteraturunderstøttet tildeling	Båndet ved 3176 cm-1 er tildelt til phenolic.	[7]	Samlet tillid

Litteratur

Referencer

Nej.	Titel	92. DOI	Side
[1]	Nardi 等 - 2013 - UV-cured transparent magnetic polymer nanocomposit	10.1016/j.polymer.2013	-
[2]	El Felss 等 - 2020 - Structural study of the effect of mineral additive	10.1007/s10971-020-05385-x	-
[3]	Cebi - 2021 - Quantification of the Geranium Essential Oil, Palm	10.3390/foods10081848	-
[4]	Kert 等 - 2021 - Application of Fragrance Microcapsules onto Cotton	10.3390/coatings11101181	12
[5]	Ashraf 等 - 2022 - Novel Silica Functionalized Monosodium GlutamateP	10.21203/rs.3.rs-283846/v1	28
[6]	Tyubaeva 等 - 2023 - Development of Nonwoven Fibrous Materials Based on	10.3390/polym15153167	7
[7]	Roy 等 - 2020 - Exploring the Inclusion Complex of a Drug (Umbelli	10.1021/acsomega.0c04716	3
[8]	Mosenfelder 等 - 2022 - Coupled hydrogen and fluorine incorporation in gar	10.2138/am-2021-7880	62

Opgradering til manuel analyse

Har du brug for en formel gennemgået rapport i stedet for standard resultatsiden?

Den aktuelle resultatside og PDF-eksport er automatiserede resultater. Vores manuelt analyserede formelle rapport er en separat manuel service, der kan forfine ordlyd, kontrollere spidsetildelinger og referencer og levere en formel rapportpakke til udkast til offentliggørelse, klientrapportering eller interne kvalitetskontrolregistre.

Manuel gennemgang af peak-tildelinger, referencer og konklusionsgrænser
Formel rapportordlyd til deling med kunder, kolleger eller manuskriptudkast
Valgfri FTIR.fun elektronisk segl bekræftelse på den gennemgåede rapport

Denne gennemgåede rapport er et FTIR.fun bekræftelsesdokument. Det erstatter ikke akkrediteret laboratoriecertificering eller juridiske/regulatoriske konklusioner.

Indsend manuelt analyseret formel rapport

Your request will be linked to result 20250729045546460431846 so you do not need to explain the result from scratch.

Bilag

Prøveinformation og råt spektrum

Originalt uploadet spektrum til reference og verifikation.

Baseline-korrektionsmetode: Asymmetrisk mindste kvadraters udjævning

Bølgelængdeområdet til analyse(cm-1): N/A

Rå spektrum uden baseline-korrektion eller anden behandling: