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(1R,3S)-cembra-4,7,11,15-tetraen-3-ol

View entire compound with spectra: 1 MS (GC)

(1R,3S)-cembra-4,7,11,15-tetraen-3-ol
SpectraBase Compound ID H8FGFuGMZ4m
InChI InChI=1S/C20H32O/c1-15(2)19-13-12-17(4)9-6-8-16(3)10-7-11-18(5)20(21)14-19/h9-11,19-21H,1,6-8,12-14H2,2-5H3/b16-10-,17-9+,18-11+/t19-,20+/m0/s1
InChIKey JMLCJQLPSRCUBV-OBENEAGUSA-N
Mol Weight 288.5 g/mol
Molecular Formula C20H32O
Exact Mass 288.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NAwvyh21iZ
Name (1R,3S)-cembra-4,7,11,15-tetraen-3-ol
CAS Registry Number 79859-57-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O
InChI InChI=1S/C20H32O/c1-15(2)19-13-12-17(4)9-6-8-16(3)10-7-11-18(5)20(21)14-19/h9-11,19-21H,1,6-8,12-14H2,2-5H3/b16-10-,17-9+,18-11+/t19-,20+/m0/s1
InChIKey JMLCJQLPSRCUBV-OBENEAGUSA-N
Molecular Weight 288.475 g/mol
SMILES O[C@]1(\C(=C\C\C=C/(CC\C=C\(CC[C@@](C1)(C(=C)C)[H])C)C)C)[H]
SPLASH splash10-0acc-6910000000-49578740ed2ee169c450
Source of Spectrum B-34-1555-0
Wiley ID 1292218