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(4aR,6aS,6bR,10S,12aR)-10-methoxy-2,2,4a,6a,6b,9,9,12a-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene

View entire compound with spectra: 1 MS (GC)

(4aR,6aS,6bR,10S,12aR)-10-methoxy-2,2,4a,6a,6b,9,9,12a-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene
SpectraBase Compound ID 4QRrVrHHPFK
InChI InChI=1S/C31H52O/c1-26(2)16-17-28(5)18-19-30(7)21(22(28)20-26)10-11-24-29(6)14-13-25(32-9)27(3,4)23(29)12-15-31(24,30)8/h10,22-25H,11-20H2,1-9H3/t22?,23?,24?,25-,28+,29-,30+,31+/m0/s1
InChIKey LUKYDMFJBKBKJG-BPDKJRHMSA-N
Mol Weight 440.8 g/mol
Molecular Formula C31H52O
Exact Mass 440.401816 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8WOsWNlf9r1
Name (4aR,6aS,6bR,10S,12aR)-10-methoxy-2,2,4a,6a,6b,9,9,12a-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H52O
InChI InChI=1S/C31H52O/c1-26(2)16-17-28(5)18-19-30(7)21(22(28)20-26)10-11-24-29(6)14-13-25(32-9)27(3,4)23(29)12-15-31(24,30)8/h10,22-25H,11-20H2,1-9H3/t22?,23?,24?,25-,28+,29-,30+,31+/m0/s1
InChIKey LUKYDMFJBKBKJG-BPDKJRHMSA-N
Molecular Weight 440.756 g/mol
SMILES C1[C@@](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@](CC2)(CCC(C1)(C)C)C)C)C)C)(C)C)(OC)[H]
SPLASH splash10-0gb9-2980000000-3877e292c8c69679a285
Source of Spectrum Jeremy Jacob, et al. Organic Geochemistry, V. 36, 2005, P.449-461
Wiley ID 1817468