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APAAN
SpectraBase Compound ID A9UluBBg4V6
InChI InChI=1S/C10H9NO/c1-8(12)10(7-11)9-5-3-2-4-6-9/h2-6,10H,1H3
InChIKey KHNWFTMUBKJWRZ-UHFFFAOYSA-N
Mol Weight 159.19 g/mol
Molecular Formula C10H9NO
Exact Mass 159.068414 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 7QXxF9O4X1W
Name α-Phenylacetoacetonitrile
Source of Sample Cayman Chemical Company
Catalog Number 21105
Lot Number 0496520-3
Accessory DurasamplIR II
Acronyms APAAN
Apodization Function Triangular
CAS Registry Number 4468-48-8
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO
IUPAC Name α-Acetylbenzeneacetonitrile
InChI InChI=1S/C10H9NO/c1-8(12)10(7-11)9-5-3-2-4-6-9/h2-6,10H,1H3
InChIKey KHNWFTMUBKJWRZ-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES c1cccc(c1)C(C(C)=O)C#N
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms 2-Phenylacetoacetonitrile; NSC 1177; NSC 25183; NSC 55206
Technique ATR-Neat