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4-(benzylamino)-5-hydroxy-valeronitrile

View entire compound with spectra: 1 MS (GC)

4-(benzylamino)-5-hydroxy-valeronitrile
SpectraBase Compound ID CKnN3NuBQht
InChI InChI=1S/C12H16N2O/c13-8-4-7-12(10-15)14-9-11-5-2-1-3-6-11/h1-3,5-6,12,14-15H,4,7,9-10H2
InChIKey GXURVDAXLGXZTI-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C12H16N2O
Exact Mass 204.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K2fGveF6aBQ
Name 4-(benzylamino)-5-hydroxy-valeronitrile
Alternate Name(s) 5-Hydroxy-4-[(phenylmethyl)amino]pentanenitrile 5-Oxidanyl-4-[(phenylmethyl)amino]pentanenitrile 4-(benzylamino)-5-hydroxypentanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16N2O
InChI InChI=1S/C12H16N2O/c13-8-4-7-12(10-15)14-9-11-5-2-1-3-6-11/h1-3,5-6,12,14-15H,4,7,9-10H2
InChIKey GXURVDAXLGXZTI-UHFFFAOYSA-N
Molecular Weight 204.273 g/mol
SMILES OCC(CCC#N)NCc1ccccc1
SPLASH splash10-0006-9100000000-17c5a9cec517de9a6dcc
Source of Spectrum KC-57-1409-27
Wiley ID 1622978