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(4aR)-1,1,4a,6-tetramethyl-5-((3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl)-1,2,3,4,4a,5,8,8a-octahydronaphthalen-2-ol

View entire compound with spectra: 1 MS (GC)

(4aR)-1,1,4a,6-tetramethyl-5-((3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl)-1,2,3,4,4a,5,8,8a-octahydronaphthalen-2-ol
SpectraBase Compound ID 4HnJSfxJN80
InChI InChI=1S/C30H50O/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-26-25(5)18-19-27-29(6,7)28(31)20-21-30(26,27)8/h12,14,16,18,26-28,31H,9-11,13,15,17,19-21H2,1-8H3/b23-14+,24-16+/t26?,27?,28?,30-/m1/s1
InChIKey BPGVNJWOXOAFIV-OUMFBIKNSA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8RJGVoLP26f
Name (4aR)-1,1,4a,6-tetramethyl-5-((3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl)-1,2,3,4,4a,5,8,8a-octahydronaphthalen-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-26-25(5)18-19-27-29(6,7)28(31)20-21-30(26,27)8/h12,14,16,18,26-28,31H,9-11,13,15,17,19-21H2,1-8H3/b23-14+,24-16+/t26?,27?,28?,30-/m1/s1
InChIKey BPGVNJWOXOAFIV-OUMFBIKNSA-N
Molecular Weight 426.729 g/mol
SMILES OC1CC[C@]2(C(C1(C)C)CC=C(C2CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C)C
SPLASH splash10-000i-6952300000-4001bb57274876cb0f28
Source of Spectrum Lien Hoa Dieu Nguyen, et al. Phytochemistry, V. 50, 1998, P.471-476
Synonyms (13E,17E)-Polypoda-7,13,17,21-tetraen-3b-ol
Wiley ID 1817577