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3-BETA-(2-HEXADECYNYLSULFONYL)-ANDROST-5-EN-17-ONE
SpectraBase Compound ID LEkBJVXUbB7
InChI InChI=1S/C35H56O3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26-39(37,38)29-22-24-34(2)28(27-29)18-19-30-31-20-21-33(36)35(31,3)25-23-32(30)34/h18,29-32H,4-15,19-27H2,1-3H3/t29-,30-,31-,32-,34-,35-/m0/s1
InChIKey YNASOXDNWITWDV-SHDAAXGTSA-N
Mol Weight 556.9 g/mol
Molecular Formula C35H56O3S
Exact Mass 556.395017 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6r6Rht2jJny
Name 3-BETA-(2-HEXADECYNYLSULFONYL)-ANDROST-5-EN-17-ONE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H56O3S
InChI InChI=1S/C35H56O3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26-39(37,38)29-22-24-34(2)28(27-29)18-19-30-31-20-21-33(36)35(31,3)25-23-32(30)34/h18,29-32H,4-15,19-27H2,1-3H3/t29-,30-,31-,32-,34-,35-/m0/s1
InChIKey YNASOXDNWITWDV-SHDAAXGTSA-N
Literature Reference Author J.R.WILLIAMS,J.C.BOEHM
Literature Reference Citation STEROIDS,60,699(1995)
Literature Reference DOI 10.1016/0039-128x(95)00094-7
Molecular Weight 556.888 g/mol
Source File Reference UWLU73869