For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2H-2,4a-Ethanophenanthren-3-ol, dodecahydro-4b,8,8-trimethyl-7-(phenylmethoxy)-12-[(tetrahydro-2H-pyr an-2-yl)oxy]-
SpectraBase Compound ID 2qeYAAlNCNC
InChI InChI=1S/C31H46O4/c1-29(2)26-13-12-22-17-23-24(32)18-31(22,19-25(23)35-28-11-7-8-16-33-28)30(26,3)15-14-27(29)34-20-21-9-5-4-6-10-21/h4-6,9-10,22-28,32H,7-8,11-20H2,1-3H3/t22?,23-,24+,25?,26?,27?,28?,30?,31-/m0/s1
InChIKey JXFIOWKTOLWXLB-KBYBJHSDSA-N
Mol Weight 482.7 g/mol
Molecular Formula C31H46O4
Exact Mass 482.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID K39NBrZ0aTC
Name 2H-2,4a-Ethanophenanthren-3-ol, dodecahydro-4b,8,8-trimethyl-7-(phenylmethoxy)-12-[(tetrahydro-2H-pyr an-2-yl)oxy]-
CAS Registry Number 86547-44-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H46O4
InChI InChI=1S/C31H46O4/c1-29(2)26-13-12-22-17-23-24(32)18-31(22,19-25(23)35-28-11-7-8-16-33-28)30(26,3)15-14-27(29)34-20-21-9-5-4-6-10-21/h4-6,9-10,22-28,32H,7-8,11-20H2,1-3H3/t22?,23-,24+,25?,26?,27?,28?,30?,31-/m0/s1
InChIKey JXFIOWKTOLWXLB-KBYBJHSDSA-N
Molecular Weight 482.705 g/mol
SMILES O[C@]1([C@@]2(CC3[C@@](C4(C(C(C)(C)C(CC4)OCc4ccccc4)CC3)C)(CC2OC2OCCCC2)C1)[H])[H]
SPLASH splash10-000f-9020000000-70e3887fa97ecf594290
Source of Spectrum H-66-768-0
Synonyms 3.beta.-Benzyloxy-12.beta.-(3,4,5,6-tetrahydro-2H-pyran-2-yl)oxy-9.beta.,13.beta.-ethano-9.beta.-podocarpan-15-ol
Wiley ID 1395714