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(E,2R)-2-benzyl-2-hydroxy-pent-3-enenitrile
SpectraBase Compound ID JqOO5g9Mq8G
InChI InChI=1S/C12H13NO/c1-2-8-12(14,10-13)9-11-6-4-3-5-7-11/h2-8,14H,9H2,1H3/b8-2+/t12-/m0/s1
InChIKey KLRGRRRZFFFYRB-NKWNXKNASA-N
Mol Weight 187.24 g/mol
Molecular Formula C12H13NO
Exact Mass 187.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HieTyLlel8W
Name (E,2R)-2-benzyl-2-hydroxy-pent-3-enenitrile
Alternate Name(s) (E,2R)-2-hydroxy-2-(phenylmethyl)-3-pentenenitrile (E,2R)-2-oxidanyl-2-(phenylmethyl)pent-3-enenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO
InChI InChI=1S/C12H13NO/c1-2-8-12(14,10-13)9-11-6-4-3-5-7-11/h2-8,14H,9H2,1H3/b8-2+/t12-/m0/s1
InChIKey KLRGRRRZFFFYRB-NKWNXKNASA-N
Molecular Weight 187.242 g/mol
SMILES O[C@@](C#N)(\C=C\C)Cc1ccccc1
SPLASH splash10-00kf-9100000000-6a446422435e40404a4e
Source of Spectrum J-62-6886-6
Wiley ID 1184004