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Hexanoic acid, 6-cyano-
SpectraBase Compound ID 1TQzido72aU
InChI InChI=1S/C7H11NO2/c8-6-4-2-1-3-5-7(9)10/h1-5H2,(H,9,10)
InChIKey INHNHRQXVDVIDZ-UHFFFAOYSA-N
Mol Weight 141.17 g/mol
Molecular Formula C7H11NO2
Exact Mass 141.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJ7skahLRkm
Name Hexanoic acid, 6-cyano-
Alternate Name(s) .epsilon.-Cyanocaproic acid 6-Cyanocaproic acid 6-Cyanohexanoic acid EINECS 227-023-0
CAS Registry Number 5602-19-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11NO2
InChI InChI=1S/C7H11NO2/c8-6-4-2-1-3-5-7(9)10/h1-5H2,(H,9,10)
InChIKey INHNHRQXVDVIDZ-UHFFFAOYSA-N
Molecular Weight 141.170 g/mol
SMILES OC(=O)CCCCCC#N
SPLASH splash10-0ar3-9000000000-daf2fc3740305bd56857
Source of Spectrum IC-189-0-0
Wiley ID 1140165