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[1,1':4',1''-Tercyclohexan]-3-ol, 4''-propyl-, propanoate, [1.alpha.[trans(trans)],3.alpha.]-
SpectraBase Compound ID 8iMpMVkBtZK
InChI InChI=1S/C24H42O2/c1-3-6-18-9-11-19(12-10-18)20-13-15-21(16-14-20)22-7-5-8-23(17-22)26-24(25)4-2/h18-23H,3-17H2,1-2H3/t18-,19-,20?,21?,22-,23+/m0/s1
InChIKey WNIIISRJPDOPAY-HBCDQXDASA-N
Mol Weight 362.6 g/mol
Molecular Formula C24H42O2
Exact Mass 362.318481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1fq6f6K6DYP
Name [1,1':4',1''-Tercyclohexan]-3-ol, 4''-propyl-, propanoate, [1.alpha.[trans(trans)],3.alpha.]-
Alternate Name(s) (1R,3S)-3-[4-(4-propylcyclohexyl)cyclohexyl]cyclohexyl propanoate r-1-(propionyloxy)-cis-3-[trans-4-(trans-4-propylcyclohexyl)cyclohexyl]cyclohexane [1,1':4',1''-tercyclohexan]-3-ol, 4''-propyl-, propanoate, [1.alpha.[trans(trans)],3.alpha.]-
CAS Registry Number 101630-55-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H42O2
InChI InChI=1S/C24H42O2/c1-3-6-18-9-11-19(12-10-18)20-13-15-21(16-14-20)22-7-5-8-23(17-22)26-24(25)4-2/h18-23H,3-17H2,1-2H3/t18-,19-,20?,21?,22-,23+/m0/s1
InChIKey WNIIISRJPDOPAY-HBCDQXDASA-N
Molecular Weight 362.598 g/mol
SMILES C(O[C@]1(C[C@@](C2CCC(CC2)[C@]2(CC[C@@](CC2)(CCC)[H])[H])(CCC1)[H])[H])(=O)CC
SPLASH splash10-0ik9-0009000000-a271baf08f4d28338e22
Source of Spectrum K-119-395-10
Wiley ID 1350017