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4-(1-Hydroxy-2-methyl-3-butenyl)benzonitrile
SpectraBase Compound ID DyY5mzwbJqu
InChI InChI=1S/C12H13NO/c1-3-9(2)12(14)11-6-4-10(8-13)5-7-11/h3-7,9,12,14H,1H2,2H3
InChIKey RWSFDBPEKOQHEQ-UHFFFAOYSA-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 1lG5zo90oZ0
Name BENZONITRILE, 4-(1-HYDROXY-2-METHYL-3-BUTENYL)-, (R*,R*)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H13NO
InChI InChI=1S/C12H13NO/c1-3-9(2)12(14)11-6-4-10(8-13)5-7-11/h3-7,9,12,14H,1H2,2H3
InChIKey RWSFDBPEKOQHEQ-UHFFFAOYSA-N
Molecular Weight 187.0994
SMILES OC(C(C=C)C)c1ccc(C#N)cc1
SPLASH splash10-001i-6900000000-7a3fb5ca929700fc06e4
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany