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5-(2-Cyanophenyl)-3-methylpent-2-enoic acid
SpectraBase Compound ID GcbHXGPmjyd
InChI InChI=1S/C13H13NO2/c1-10(8-13(15)16)6-7-11-4-2-3-5-12(11)9-14/h2-5,8H,6-7H2,1H3,(H,15,16)/b10-8+
InChIKey FOOCAHQZVZIPMB-CSKARUKUSA-N
Mol Weight 215.25 g/mol
Molecular Formula C13H13NO2
Exact Mass 215.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdPxpneBaiV
Name 5-(2-Cyanophenyl)-3-methylpent-2-enoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO2
InChI InChI=1S/C13H13NO2/c1-10(8-13(15)16)6-7-11-4-2-3-5-12(11)9-14/h2-5,8H,6-7H2,1H3,(H,15,16)/b10-8+
InChIKey FOOCAHQZVZIPMB-CSKARUKUSA-N
Molecular Weight 215.252 g/mol
SMILES OC(\C=C\(CCc1c(C#N)cccc1)C)=O
SPLASH splash10-014j-0900000000-c77909b982bfbae69091
Source of Spectrum SO-0-278-21
Synonyms (2E)-5-(2-cyanophenyl)-3-methyl-2-pentenoic acid
Wiley ID 877330