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2,4-Cycloheptadiene-1-acetic acid, 6-methyl-, cis-
SpectraBase Compound ID 4N4Jf4PZtLf
InChI InChI=1S/C10H14O2/c1-8-4-2-3-5-9(6-8)7-10(11)12/h2-5,8-9H,6-7H2,1H3,(H,11,12)/t8-,9+/m1/s1
InChIKey VJDZLPIJTVYZHX-BDAKNGLRSA-N
Mol Weight 166.22 g/mol
Molecular Formula C10H14O2
Exact Mass 166.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BoIR52uw7rK
Name 2,4-Cycloheptadiene-1-acetic acid, 6-methyl-, cis-
CAS Registry Number 91550-44-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O2
InChI InChI=1S/C10H14O2/c1-8-4-2-3-5-9(6-8)7-10(11)12/h2-5,8-9H,6-7H2,1H3,(H,11,12)/t8-,9+/m1/s1
InChIKey VJDZLPIJTVYZHX-BDAKNGLRSA-N
Molecular Weight 166.220 g/mol
SMILES OC(=O)C[C@]1(C=CC=C[C@](C1)(C)[H])[H]
SPLASH splash10-05mo-5900000000-8d908ffe905e2b6d531d
Source of Spectrum C-106-6072-0
Synonyms 6-Methylcyclohepta-2,4-dienylacetic acid [(1S,6S)-6-methyl-2,4-cycloheptadien-1-yl]acetic acid
Wiley ID 1162537