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2-(2,6-Dimethyl-6-ethenylcyclohex-1-enyl)acetic acid
SpectraBase Compound ID AE51XZFZjVC
InChI InChI=1S/C12H18O2/c1-4-12(3)7-5-6-9(2)10(12)8-11(13)14/h4H,1,5-8H2,2-3H3,(H,13,14)
InChIKey PGIRCYZNCARRGJ-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xAQrUhx2m
Name 2-(2,6-Dimethyl-6-ethenylcyclohex-1-enyl)acetic acid
Appearance Off white solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-4-12(3)7-5-6-9(2)10(12)8-11(13)14/h4H,1,5-8H2,2-3H3,(H,13,14)
InChIKey PGIRCYZNCARRGJ-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C or Agilent 6890-5973N
Ionization Type EI
Molecular Weight 194.274 g/mol
SMILES OC(CC1=C(CCCC1(C=C)C)C)=O
SPLASH splash10-0159-0900000000-37c4d87852d652197503
Source of Spectrum WO2017184870A1
Wiley ID 1855500