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(3R)-3-Hydroxy-5-oxo-5-phenylpentanenitrile
SpectraBase Compound ID A8CUDQVZFEd
InChI InChI=1S/C11H11NO2/c12-7-6-10(13)8-11(14)9-4-2-1-3-5-9/h1-5,10,13H,6,8H2/t10-/m1/s1
InChIKey WPOGPGFVPUEHAW-SNVBAGLBSA-N
Mol Weight 189.21 g/mol
Molecular Formula C11H11NO2
Exact Mass 189.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhuG2r7NxvX
Name (3R)-3-Hydroxy-5-oxo-5-phenylpentanenitrile
Alternate Name(s) (3R)-3-hydroxy-5-keto-5-phenyl-valeronitrile (3R)-3-oxidanyl-5-oxidanylidene-5-phenyl-pentanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO2
InChI InChI=1S/C11H11NO2/c12-7-6-10(13)8-11(14)9-4-2-1-3-5-9/h1-5,10,13H,6,8H2/t10-/m1/s1
InChIKey WPOGPGFVPUEHAW-SNVBAGLBSA-N
Molecular Weight 189.214 g/mol
SMILES O[C@](CC#N)(CC(=O)c1ccccc1)[H]
SPLASH splash10-0a4i-0900000000-77f8c5d0314eb06193f3
Source of Spectrum QC-10-4236-4
Wiley ID 871682