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4-(3,4-Dihydroxy-2-oxo-butylamino)-benzonitrile
SpectraBase Compound ID HC8B0cQsR8I
InChI InChI=1S/C11H12N2O3/c12-5-8-1-3-9(4-2-8)13-6-10(15)11(16)7-14/h1-4,11,13-14,16H,6-7H2
InChIKey KXYMGYWTHOHAHZ-UHFFFAOYSA-N
Mol Weight 220.23 g/mol
Molecular Formula C11H12N2O3
Exact Mass 220.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7W3CdRqfarp
Name 4-(3,4-Dihydroxy-2-oxo-butylamino)-benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N2O3
InChI InChI=1S/C11H12N2O3/c12-5-8-1-3-9(4-2-8)13-6-10(15)11(16)7-14/h1-4,11,13-14,16H,6-7H2
InChIKey KXYMGYWTHOHAHZ-UHFFFAOYSA-N
Molecular Weight 220.228 g/mol
SMILES N(c1ccc(C#N)cc1)CC(C(CO)O)=O
SPLASH splash10-001i-4900000000-80e843dfc9cada522a52
Source of Spectrum CM-1999-19476-0
Synonyms 4-[(3,4-dihydroxy-2-keto-butyl)amino]benzonitrile 4-[(3,4-dihydroxy-2-oxo-butyl)amino]benzonitrile 4-[(3,4-dihydroxy-2-oxobutyl)amino]benzonitrile 4-[[3,4-bis(oxidanyl)-2-oxidanylidene-butyl]amino]benzenecarbonitrile
Wiley ID 481830