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1,5,11-Cyclotetradecatriene-1-methanol, 8-(1,5-dimethyl-1,4-hexadienyl)-5,11-dimethyl-, [R-(Z,E,Z,E)]-
SpectraBase Compound ID 3ba1sn00rgM
InChI InChI=1S/C25H40O/c1-20(2)9-6-12-23(5)25-17-15-21(3)10-7-13-24(19-26)14-8-11-22(4)16-18-25/h9-10,12,14,16,25-26H,6-8,11,13,15,17-19H2,1-5H3/b21-10-,22-16-,23-12+,24-14+/t25-/m1/s1
InChIKey MXTBBBIZYLWNIV-FYFNSHCZSA-N
Mol Weight 356.6 g/mol
Molecular Formula C25H40O
Exact Mass 356.307916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BATKdxtJJxb
Name 1,5,11-Cyclotetradecatriene-1-methanol, 8-(1,5-dimethyl-1,4-hexadienyl)-5,11-dimethyl-, [R-(Z,E,Z,E)]-
Alternate Name(s) {(8R)-8-[(1E)-1,5-dimethyl-1,4-hexadienyl]-5,11-dimethyl-1,5,11-cyclotetradecatrien-1-yl}methanol .alpha.-cericerol I
CAS Registry Number 73544-49-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40O
InChI InChI=1S/C25H40O/c1-20(2)9-6-12-23(5)25-17-15-21(3)10-7-13-24(19-26)14-8-11-22(4)16-18-25/h9-10,12,14,16,25-26H,6-8,11,13,15,17-19H2,1-5H3/b21-10-,22-16-,23-12+,24-14+/t25-/m1/s1
InChIKey MXTBBBIZYLWNIV-FYFNSHCZSA-N
Molecular Weight 356.594 g/mol
SMILES OC\C=1CC\C=C/(CC[C@@](\C(=C\CC=C(C)C)C)(C\C=C/(CCC/1)C)[H])C
SPLASH splash10-014u-9024000000-86651c0211c4ee091e85
Source of Spectrum F-35-1916-0
Wiley ID 1346243