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5-Azulenemethanol, decahydro-3-hydroxy-.alpha.,.alpha.,3-trimethyl-8-methylene-, .alpha.-acetate, [3R-(3.alpha.,3a.alpha.,5.beta.,8a.alpha.)]-
SpectraBase Compound ID 3AXbqo9qMkp
InChI InChI=1S/C17H28O3/c1-11-6-7-13(16(3,4)20-12(2)18)10-15-14(11)8-9-17(15,5)19/h13-15,19H,1,6-10H2,2-5H3/t13-,14+,15-,17+/m0/s1
InChIKey BVCFBFNQCMEHNS-QSJFSLAZSA-N
Mol Weight 280.41 g/mol
Molecular Formula C17H28O3
Exact Mass 280.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Djog4dtYkwj
Name 5-Azulenemethanol, decahydro-3-hydroxy-.alpha.,.alpha.,3-trimethyl-8-methylene-, .alpha.-acetate, [3R-(3.alpha.,3a.alpha.,5.beta.,8a.alpha.)]-
CAS Registry Number 74799-29-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O3
InChI InChI=1S/C17H28O3/c1-11-6-7-13(16(3,4)20-12(2)18)10-15-14(11)8-9-17(15,5)19/h13-15,19H,1,6-10H2,2-5H3/t13-,14+,15-,17+/m0/s1
InChIKey BVCFBFNQCMEHNS-QSJFSLAZSA-N
Molecular Weight 280.408 g/mol
SMILES O[C@]1([C@@]2([C@@](C(CC[C@](C(OC(=O)C)(C)C)(C2)[H])=C)(CC1)[H])[H])C
SPLASH splash10-0ced-3910000000-76782f8b760ec2a59039
Source of Spectrum F-36-374-0
Synonyms 1-[(3R,3aS,5S,8aS)-3-hydroxy-3-methyl-8-methylenedecahydro-5-azulenyl]-1-methylethyl acetate 11-Acetoxy-cis-guai-lo(14)-en-4-ol
Wiley ID 1284163