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(1S,2R,4Z)-2-phenyl-1-cyclooct-4-enecarboxylic acid
SpectraBase Compound ID 5UnQEC3xBDB
InChI InChI=1S/C15H18O2/c16-15(17)14-11-7-2-1-6-10-13(14)12-8-4-3-5-9-12/h1,3-6,8-9,13-14H,2,7,10-11H2,(H,16,17)/b6-1-/t13-,14-/m0/s1
InChIKey AYKJCKRZKZGVPI-FWBYSSLLSA-N
Mol Weight 230.31 g/mol
Molecular Formula C15H18O2
Exact Mass 230.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41KE70G3O4
Name (1S,2R,4Z)-2-phenyl-1-cyclooct-4-enecarboxylic acid
Alternate Name(s) (1S,2R,4Z)-2-phenylcyclooct-4-ene-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O2
InChI InChI=1S/C15H18O2/c16-15(17)14-11-7-2-1-6-10-13(14)12-8-4-3-5-9-12/h1,3-6,8-9,13-14H,2,7,10-11H2,(H,16,17)/b6-1-/t13-,14-/m0/s1
InChIKey AYKJCKRZKZGVPI-FWBYSSLLSA-N
Molecular Weight 230.307 g/mol
SMILES OC([C@@]1([C@](c2ccccc2)(C\C=C/CCC1)[H])[H])=O
SPLASH splash10-0ufu-9410000000-4da1ef823ac5e6db04fe
Source of Spectrum SK-32-1838-6
Wiley ID 1548754