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{(1R,3aS,6aS)-1-Methyl-4-[(E)/(Z)-propylidene]perhydro-3-pentalenyl}methanol
SpectraBase Compound ID 6qGjOpXTQ6I
InChI InChI=1S/C13H22O/c1-3-4-11-5-6-12-10(2)7-8-13(11,12)9-14/h4,10,12,14H,3,5-9H2,1-2H3/b11-4+/t10-,12+,13-/m1/s1
InChIKey VQKUBHRIDKLVMW-HGBLOBMSSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KDUKhMAfnLx
Name {(1R,3aS,6aS)-1-Methyl-4-[(E)/(Z)-propylidene]perhydro-3-pentalenyl}methanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O
InChI InChI=1S/C13H22O/c1-3-4-11-5-6-12-10(2)7-8-13(11,12)9-14/h4,10,12,14H,3,5-9H2,1-2H3/b11-4+/t10-,12+,13-/m1/s1
InChIKey VQKUBHRIDKLVMW-HGBLOBMSSA-N
Molecular Weight 194.318 g/mol
SMILES OC[C@]12[C@@](CC\C2=C\CC)([C@](C)(CC1)[H])[H]
SPLASH splash10-0pb9-8900000000-465dfba1638e2f3bd58d
Source of Spectrum J-63-2703-16
Synonyms [(3R,3aS,6Z,6aS)-3-methyl-6-propylideneoctahydro-1-pentalenyl]methanol {(1R,3aS,6aS)-1-Methyl-4-[(E)/(Z)-propylidene]hexahydro-3a-pentalenyl}methanol
Wiley ID 1191550