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2-(1,1-Dimethylallyl)-2,3-dihydro-o-coumaric acid
SpectraBase Compound ID 3bcA0zPRpHl
InChI InChI=1S/C14H18O3/c1-4-14(2,3)11(13(16)17)9-10-7-5-6-8-12(10)15/h4-8,11,15H,1,9H2,2-3H3,(H,16,17)
InChIKey LSNQPHCKEDLUTC-UHFFFAOYSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BqRy7diSG
Name 2-(1,1-Dimethylallyl)-2,3-dihydro-o-coumaric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-4-14(2,3)11(13(16)17)9-10-7-5-6-8-12(10)15/h4-8,11,15H,1,9H2,2-3H3,(H,16,17)
InChIKey LSNQPHCKEDLUTC-UHFFFAOYSA-N
Molecular Weight 234.295 g/mol
SMILES Oc1c(CC(C(=O)O)C(C=C)(C)C)cccc1
SPLASH splash10-066s-4910000000-fedd0865d7c230861a0e
Source of Spectrum F-49-1708-13
Synonyms (2E)-3-[6-(1,1-dimethyl-2-propenyl)-6-hydroxy-1,3-cyclohexadien-1-yl]-2-propenoic acid 2-(2-Hydroxy-benzyl)-3,3-dimethyl-pent-4-enoic acid 2-[(2-hydroxyphenyl)methyl]-3,3-dimethyl-4-pentenoic acid 2-[(2-hydroxyphenyl)methyl]-3,3-dimethylpent-4-enoic acid 2-[(2-hydroxyphenyl)methyl]-3,3-dimethyl-pent-4-enoic acid
Wiley ID 1236192