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(8R,9S,10R,11S,13S,14R)-11-(4-methoxyphenyl)-13-methyl-17-spiro[1,2,4,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]one

View entire compound with spectra: 1 MS (GC)

(8R,9S,10R,11S,13S,14R)-11-(4-methoxyphenyl)-13-methyl-17-spiro[1,2,4,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]one
SpectraBase Compound ID A5LlMzgjgxp
InChI InChI=1S/C27H32O4/c1-26-16-22(17-3-6-19(29-2)7-4-17)25-20-11-12-27(30-13-14-31-27)15-18(20)5-8-21(25)23(26)9-10-24(26)28/h3-7,9-10,20-23,25H,8,11-16H2,1-2H3/t20-,21-,22+,23+,25+,26-/m0/s1
InChIKey OYJKNNFGBTZERZ-KZPACXBASA-N
Mol Weight 420.5 g/mol
Molecular Formula C27H32O4
Exact Mass 420.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GquR1wxQETi
Name (8R,9S,10R,11S,13S,14R)-11-(4-methoxyphenyl)-13-methyl-17-spiro[1,2,4,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]one
Alternate Name(s) (8R,9S,10R,11S,13S,14R)-11-(4-methoxyphenyl)-13-methyl-spiro[1,2,4,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H32O4
InChI InChI=1S/C27H32O4/c1-26-16-22(17-3-6-19(29-2)7-4-17)25-20-11-12-27(30-13-14-31-27)15-18(20)5-8-21(25)23(26)9-10-24(26)28/h3-7,9-10,20-23,25H,8,11-16H2,1-2H3/t20-,21-,22+,23+,25+,26-/m0/s1
InChIKey OYJKNNFGBTZERZ-KZPACXBASA-N
Molecular Weight 420.549 g/mol
SMILES [C@@]12([C@@]([C@@]3(CC=C4[C@@]([C@]3([C@](C2)(c2ccc(cc2)OC)[H])[H])(CCC2(OCCO2)C4)[H])[H])(C=CC1=O)[H])C
SPLASH splash10-0002-9100000000-6fba5c1bd66b6e247bf3
Source of Spectrum F-51-5569-13
Wiley ID 791918