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8,11a-Methano-11aH-cyclohepta[a]naphthalen-10(11H)-one, 5,6,6a,7,8,9-hexahydro-3-methoxy-9-methyl-, (6a.alpha.,8.beta.,11a.beta.)-(.+-.)-
SpectraBase Compound ID 23jB04EdH2H
InChI InChI=1S/C18H22O2/c1-11-13-7-14-4-3-12-8-15(20-2)5-6-16(12)18(14,9-13)10-17(11)19/h5-6,8,11,13-14H,3-4,7,9-10H2,1-2H3/t11-,13+,14+,18+/m0/s1
InChIKey XQXKHOWFGZJWRQ-VMXFXAJASA-N
Mol Weight 270.37 g/mol
Molecular Formula C18H22O2
Exact Mass 270.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IITGkMTzBWl
Name 8,11a-Methano-11aH-cyclohepta[a]naphthalen-10(11H)-one, 5,6,6a,7,8,9-hexahydro-3-methoxy-9-methyl-, (6a.alpha.,8.beta.,11a.beta.)-(.+-.)-
CAS Registry Number 94781-21-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O2
InChI InChI=1S/C18H22O2/c1-11-13-7-14-4-3-12-8-15(20-2)5-6-16(12)18(14,9-13)10-17(11)19/h5-6,8,11,13-14H,3-4,7,9-10H2,1-2H3/t11-,13+,14+,18+/m0/s1
InChIKey XQXKHOWFGZJWRQ-VMXFXAJASA-N
Molecular Weight 270.372 g/mol
SMILES [C@@]123c4c(cc(cc4)OC)CC[C@@]1(C[C@](C2)([C@@](C(C3)=O)(C)[H])[H])[H]
SPLASH splash10-0002-0930000000-067999aa4b1d496d2004
Source of Spectrum J-50-862-34
Synonyms (1R,10R,12R,13S)-5-methoxy-13-methyltetracyclo[10.3.1.0(1,10).0(2,7)]hexadeca-2,4,6-trien-14-one 7-Methoxy-12.alpha.-methyl-2,3,3a.beta.,4,5,9b-hexahydro-2.beta.,9b.beta.-propano-1H-benz[e]inden-11-one
Wiley ID 1274797