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18-Nor-16-oxaandrosta-13(17),14-diene-4-methanol, 4,8-dimethyl-, methanesulfonate, (4.beta.,5.alpha.)-
SpectraBase Compound ID CzgPtaDDooS
InChI InChI=1S/C21H32O4S/c1-19(14-25-26(4,22)23)9-5-10-21(3)17(19)8-11-20(2)16-13-24-12-15(16)6-7-18(20)21/h12-13,17-18H,5-11,14H2,1-4H3/t17-,18-,19+,20?,21-/m0/s1
InChIKey SSOBBPIXTYBZJA-JKMPKNINSA-N
Mol Weight 380.5 g/mol
Molecular Formula C21H32O4S
Exact Mass 380.202131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKrXC7lsmEw
Name 18-Nor-16-oxaandrosta-13(17),14-diene-4-methanol, 4,8-dimethyl-, methanesulfonate, (4.beta.,5.alpha.)-
CAS Registry Number 74804-04-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O4S
InChI InChI=1S/C21H32O4S/c1-19(14-25-26(4,22)23)9-5-10-21(3)17(19)8-11-20(2)16-13-24-12-15(16)6-7-18(20)21/h12-13,17-18H,5-11,14H2,1-4H3/t17-,18-,19+,20?,21-/m0/s1
InChIKey SSOBBPIXTYBZJA-JKMPKNINSA-N
Molecular Weight 380.543 g/mol
SMILES C12(c3c(coc3)CC[C@@]2([C@]2(CCC[C@@]([C@@]2(CC1)[H])(COS(=O)(=O)C)C)C)[H])C
SPLASH splash10-001i-0209000000-a291f58f5f7828a3cf37
Source of Spectrum AN-89-403-0
Synonyms Mesylate of Spongia-13(16),14-dien-19-ol Phenanthro[1,2-c]furan, 18-nor-16-oxaandrosta-13(17),14-diene-4-methanol deriv. [(5aR,6S,9aR,9bR)-3b,6,9a-trimethyl-3b,4,5,5a,6,7,8,9,9a,9b,10,11-dodecahydrophenanthro[1,2-c]furan-6-yl]methyl methanesulfonate
Wiley ID 1359719