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(1S,6S)-(1R,2S,5R)-2-(2-(6-methoxy-naphthalen-2-yl)propan-2-yl)-5-methyl-cyclohexyl-5-oxobicyclo-[4.2.0]octane-1-carboxylate

View entire compound with spectra: 1 MS (GC)

(1S,6S)-(1R,2S,5R)-2-(2-(6-methoxy-naphthalen-2-yl)propan-2-yl)-5-methyl-cyclohexyl-5-oxobicyclo-[4.2.0]octane-1-carboxylate
SpectraBase Compound ID 3nLFaKA2c8t
InChI InChI=1S/C30H38O4/c1-19-7-12-25(27(16-19)34-28(32)30-14-5-6-26(31)24(30)13-15-30)29(2,3)22-10-8-21-18-23(33-4)11-9-20(21)17-22/h8-11,17-19,24-25,27H,5-7,12-16H2,1-4H3/t19-,24-,25-,27-,30+/m1/s1
InChIKey MHJKDOSQYSRLFD-WWIHUHEBSA-N
Mol Weight 462.6 g/mol
Molecular Formula C30H38O4
Exact Mass 462.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HeQH7gr7h8x
Name (1S,6S)-(1R,2S,5R)-2-(2-(6-methoxy-naphthalen-2-yl)propan-2-yl)-5-methyl-cyclohexyl-5-oxobicyclo-[4.2.0]octane-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H38O4
InChI InChI=1S/C30H38O4/c1-19-7-12-25(27(16-19)34-28(32)30-14-5-6-26(31)24(30)13-15-30)29(2,3)22-10-8-21-18-23(33-4)11-9-20(21)17-22/h8-11,17-19,24-25,27H,5-7,12-16H2,1-4H3/t19-,24-,25-,27-,30+/m1/s1
InChIKey MHJKDOSQYSRLFD-WWIHUHEBSA-N
Molecular Weight 462.630 g/mol
SMILES [C@]12(C(O[C@]3([C@](C(c4cc5ccc(cc5cc4)OC)(C)C)(CC[C@](C3)(C)[H])[H])[H])=O)[C@](C(=O)CCC2)([H])CC1
SPLASH splash10-0002-0920000000-dea1e2512f9435c4685a
Source of Spectrum F-69-788-2bc
Synonyms (1S,6S)-(1R,2S,5R)-2-(2-(6-methoxy-naphthalen-2-yl)propan-2-yl)-5-methylcyclohexyl5-oxobicyclo-[4.2.0]octane-1-carboxylate (1S,6S)-(1R,2S,5R)-2-(2-(6-methoxynaphthalen-2-yl)propan-2-yl)-5-methylcyclohexyl 5-oxobicyclo[4.2.0]octane-1-carboxylate
Wiley ID 1737466