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1,3-Propanediol, 1-cyclohexyl-2-ethenyl-, [S-(R*,S*)]-
SpectraBase Compound ID 9Xi8LC5ynhl
InChI InChI=1S/C11H20O2/c1-2-9(8-12)11(13)10-6-4-3-5-7-10/h2,9-13H,1,3-8H2/t9-,11-/m1/s1
InChIKey KVQYJIHCPGXRBR-MWLCHTKSSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H20O2
Exact Mass 184.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5hA1zVMuW9
Name 1,3-Propanediol, 1-cyclohexyl-2-ethenyl-, [S-(R*,S*)]-
CAS Registry Number 129065-00-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O2
InChI InChI=1S/C11H20O2/c1-2-9(8-12)11(13)10-6-4-3-5-7-10/h2,9-13H,1,3-8H2/t9-,11-/m1/s1
InChIKey KVQYJIHCPGXRBR-MWLCHTKSSA-N
Molecular Weight 184.279 g/mol
SMILES OC[C@]([C@](C1CCCCC1)(O)[H])(C=C)[H]
SPLASH splash10-0ue9-9000000000-23a486881a804089ebd2
Source of Spectrum C-112-6347-14
Synonyms (1S,2R)-1-cyclohexyl-2-vinyl-1,3-propanediol 1-[(1-hydroxy-2-hydroxymethyl)but-3-enyl]cyclohexane
Wiley ID 1181025