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1.beta.,4,4a,9,10,10a.alpha.-hexahydro-7-methoxy-1.alpha.,4a.beta.-dimethylphenanthrene
SpectraBase Compound ID FToAbudaq0z
InChI InChI=1S/C17H22O/c1-12-5-4-10-17(2)15(12)8-6-13-11-14(18-3)7-9-16(13)17/h4-5,7,9,11-12,15H,6,8,10H2,1-3H3/t12-,15+,17+/m1/s1
InChIKey QXAPNUGMPFIRLH-PVUWLOKVSA-N
Mol Weight 242.36 g/mol
Molecular Formula C17H22O
Exact Mass 242.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5aKadkQbDkU
Name 1.beta.,4,4a,9,10,10a.alpha.-hexahydro-7-methoxy-1.alpha.,4a.beta.-dimethylphenanthrene
CAS Registry Number 113998-24-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O
InChI InChI=1S/C17H22O/c1-12-5-4-10-17(2)15(12)8-6-13-11-14(18-3)7-9-16(13)17/h4-5,7,9,11-12,15H,6,8,10H2,1-3H3/t12-,15+,17+/m1/s1
InChIKey QXAPNUGMPFIRLH-PVUWLOKVSA-N
Molecular Weight 242.362 g/mol
SMILES [C@]12(c3c(cc(cc3)OC)CC[C@]1([C@@](C)([H])C=CC2)[H])C
SPLASH splash10-00bc-0890000000-8e28826c0d8c53965ee6
Source of Spectrum J-53-2596-12
Synonyms (1R,4aS,10aS)-7-methoxy-1,4a-dimethyl-1,4,4a,9,10,10a-hexahydrophenanthrene (4bS,8R,8aS)-4b,8-dimethyl-4b,5,8,8a,9,10-hexahydro-2-phenanthrenyl methyl ether
Wiley ID 1245666