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12.alpha.-Hydroxy-5',5'-dimethyl-spiro[androsta1,4-diene-17,2'-[1,3]dioxan]-3-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

12.alpha.-Hydroxy-5',5'-dimethyl-spiro[androsta1,4-diene-17,2'-[1,3]dioxan]-3-one
SpectraBase Compound ID Fvsi2FYmDfy
InChI InChI=1S/C24H34O4/c1-21(2)13-27-24(28-14-21)10-8-18-17-6-5-15-11-16(25)7-9-22(15,3)19(17)12-20(26)23(18,24)4/h7,9,11,17-20,26H,5-6,8,10,12-14H2,1-4H3/t17-,18-,19-,20-,22-,23+/m0/s1
InChIKey YCISWFOYXKTNBP-AEZRXPCCSA-N
Mol Weight 386.5 g/mol
Molecular Formula C24H34O4
Exact Mass 386.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6E8aMVDJukh
Name 12.alpha.-Hydroxy-5',5'-dimethyl-spiro[androsta1,4-diene-17,2'-[1,3]dioxan]-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H34O4
InChI InChI=1S/C24H34O4/c1-21(2)13-27-24(28-14-21)10-8-18-17-6-5-15-11-16(25)7-9-22(15,3)19(17)12-20(26)23(18,24)4/h7,9,11,17-20,26H,5-6,8,10,12-14H2,1-4H3/t17-,18-,19-,20-,22-,23+/m0/s1
InChIKey YCISWFOYXKTNBP-AEZRXPCCSA-N
Molecular Weight 386.532 g/mol
SMILES O[C@@]1([C@]2([C@]([C@@]3(CCC=4[C@@]([C@]3(C1)[H])(C=CC(=O)C4)C)[H])(CCC21OCC(CO1)(C)C)[H])C)[H]
SPLASH splash10-0006-4910000000-c18a879598e4a0effde2
Source of Spectrum B-51-356-2
Synonyms (1'S,2'R,10'R,11'S,15'R,16'S)-16'-hydroxy-2',5,5,15'-tetramethylspiro[1,3-dioxane-2,14'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane]-3',6'-dien-5'-one
Wiley ID 746152