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LAEVINOL_A;6-ALPHA-ACETYL-4-BETA,5-BETA-DIMETHYL-1-(10)-ENE-2-ALPHA-HYDROXY-7-ALPHA-FORMYLOXYDECALIN
SpectraBase Compound ID DVr3DbHZLdG
InChI InChI=1S/C15H22O4/c1-9-6-12(18)7-11-4-5-13(19-8-16)14(10(2)17)15(9,11)3/h7-9,12-14,18H,4-6H2,1-3H3/t9-,12-,13-,14-,15+/m0/s1
InChIKey SOBSKWVVRYYQRP-XOKYVNOHSA-N
Mol Weight 266.34 g/mol
Molecular Formula C15H22O4
Exact Mass 266.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BohoIJkGcnl
Name 6.alpha.-acetyl-4.beta.,5.beta.-dimethyl-1(10)-ene-2.alpha.-hydroxy-7.alpha.-formyloxydecalin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O4
InChI InChI=1S/C15H22O4/c1-9-6-12(18)7-11-4-5-13(19-8-16)14(10(2)17)15(9,11)3/h7-9,12-14,18H,4-6H2,1-3H3/t9-,12-,13-,14-,15+/m0/s1
InChIKey SOBSKWVVRYYQRP-XOKYVNOHSA-N
Instrument Name JEOL JMS-SX/SX 102A
Ionization Type EI
Literature Reference DOI 10.1021/np050326r
Molecular Weight 266.337 g/mol
Optical Rotation [a]D25 = -173 (c = 0.4, CHCl3)
Reported Formula C15H22O4
SMILES O[C@@]1(C=C2[C@@]([C@](C1)(C)[H])([C@]([C@](CC2)(OC=O)[H])(C(=O)C)[H])C)[H]
SPLASH splash10-03di-0930000000-c02589029291f25e807e
Source of Spectrum G4-68-1751-1
Synonyms Laevinol A
Wiley ID 1879495