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3-amino-3-(4-cyanophenyl)propionic acid
SpectraBase Compound ID 4Tw02P6Mmaf
InChI InChI=1S/C10H10N2O2/c11-6-7-1-3-8(4-2-7)9(12)5-10(13)14/h1-4,9H,5,12H2,(H,13,14)
InChIKey JFPLLJRLBHIJPS-UHFFFAOYSA-N
Mol Weight 190.2 g/mol
Molecular Formula C10H10N2O2
Exact Mass 190.074228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A0DGQQY7EAc
Name 3-Amino-3-(4-cyanophenyl)propanoic acid
Alternate Name(s) 3-Amino-3-(4-cyanophenyl)propionic acid 3-Azanyl-3-(4-cyanophenyl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10N2O2
InChI InChI=1S/C10H10N2O2/c11-6-7-1-3-8(4-2-7)9(12)5-10(13)14/h1-4,9H,5,12H2,(H,13,14)
InChIKey JFPLLJRLBHIJPS-UHFFFAOYSA-N
Molecular Weight 190.202 g/mol
SMILES NC(CC(=O)O)c1ccc(cc1)C#N
SPLASH splash10-001i-0900000000-59ccda9f23456d77e2c2
Source of Spectrum KD-15-1895-1
Wiley ID 1637037