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6.beta.-methoxy-21,22-epoxy-3.alpha.,5.alpha.-cyclobisnorcholane
SpectraBase Compound ID CdXIFWwV2ea
InChI InChI=1S/C23H36O2/c1-3-21-19(12-25-21)16-6-5-15-14(16)7-8-17-18(15)10-22(24-2)23-11-13(23)4-9-20(17)23/h13-22H,3-12H2,1-2H3/t13-,14?,15-,16+,17+,18+,19+,20?,21?,22-,23?/m1/s1
InChIKey GBDOJQKAECVBLT-HXHAVNHUSA-N
Mol Weight 344.5 g/mol
Molecular Formula C23H36O2
Exact Mass 344.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5XEPSZV10ja
Name 6.beta.-methoxy-21,22-epoxy-3.alpha.,5.alpha.-cyclobisnorcholane
CAS Registry Number 119005-04-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O2
InChI InChI=1S/C23H36O2/c1-3-21-19(12-25-21)16-6-5-15-14(16)7-8-17-18(15)10-22(24-2)23-11-13(23)4-9-20(17)23/h13-22H,3-12H2,1-2H3/t13-,14?,15-,16+,17+,18+,19+,20?,21?,22-,23?/m1/s1
InChIKey GBDOJQKAECVBLT-HXHAVNHUSA-N
Molecular Weight 344.539 g/mol
SMILES C123[C@](CCC3[C@]3(CCC4[C@]([C@@]3(C[C@]1(OC)[H])[H])(CC[C@@]4([C@@]1(COC1CC)[H])[H])[H])[H])(C2)[H]
SPLASH splash10-002r-0069000000-3e0db6c16fac22bfbd81
Source of Spectrum J-55-3491-22
Synonyms (1aR,3bS,6S,8aR,8bS,10R,10aS)-6-[(3R)-2-ethyloxetanyl]hexadecahydrocyclopenta[a]cyclopropa[2,3]cyclopenta[1,2-f]naphthalen-10-yl methyl ether (3R)-3-[(1aR,3bS,6S,8aR,8bS,10R,10aS)-10-methoxyhexadecahydrocyclopenta[a]cyclopropa[2,3]cyclopenta[1,2-f]naphthalen-6-yl]-2-ethyloxetane
Wiley ID 1338351