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Benzenebutanoic acid, .gamma.-cyano-.gamma.-(propylideneamino)-, methyl ester
SpectraBase Compound ID KJl5nDjwzKb
InChI InChI=1S/C15H18N2O2/c1-3-11-17-15(12-16,10-9-14(18)19-2)13-7-5-4-6-8-13/h4-8,11H,3,9-10H2,1-2H3/b17-11-
InChIKey FZDQAFKUSQLFSI-BOPFTXTBSA-N
Mol Weight 258.32 g/mol
Molecular Formula C15H18N2O2
Exact Mass 258.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZryvKMAmgq
Name Benzenebutanoic acid, .gamma.-cyano-.gamma.-(propylideneamino)-, methyl ester
Alternate Name(s) 4-Propylideneamino-4-cyano-4-phenylbutanoic acid methyl ester Methyl 4-cyano-4-phenyl-4-[(Z)-propylideneamino]butanoate
CAS Registry Number 113543-66-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18N2O2
InChI InChI=1S/C15H18N2O2/c1-3-11-17-15(12-16,10-9-14(18)19-2)13-7-5-4-6-8-13/h4-8,11H,3,9-10H2,1-2H3/b17-11-
InChIKey FZDQAFKUSQLFSI-BOPFTXTBSA-N
Molecular Weight 258.321 g/mol
SMILES C(C#N)(\N=C/CC)(CCC(=O)OC)c1ccccc1
SPLASH splash10-00kf-2900000000-eeff3647addfb828b48d
Source of Spectrum AJ-60-3353-2
Wiley ID 1261911