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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

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 42Cg4NNXNiA
Name α-Phenylacetoacetonitrile
Source of Sample Cayman Chemical Company
Catalog Number 21105
Lot Number 0496520-3
Acronyms APAAN
CAS Registry Number 4468-48-8
Cell Type Capillary tube
Compound Type Pure
Copyright Copyright © 2015-2024 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
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 597 mW
Raman Laser Source Nd:YAG
SMILES c1cccc(c1)C(C(C)=O)C#N
Scans Performed 4096
Source of Spectrum Forensic Spectral Research
Synonyms 2-Phenylacetoacetonitrile; NSC 1177; NSC 25183; NSC 55206
Technique FT-Raman