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2-[6-SPIRO-(3-BETA,17-BETA-DIACETOXYANDROST-4-ENYL)-4,5-BENZO-2[H]-THIAZOLE
SpectraBase Compound ID DbtREQ8bNDI
InChI InChI=1S/C29H37NO4S/c1-17(31)33-19-11-13-27(3)22-12-14-28(4)21(9-10-26(28)34-18(2)32)20(22)16-29(25(27)15-19)30-23-7-5-6-8-24(23)35-29/h5-8,15,19-22,26,30H,9-14,16H2,1-4H3/t19-,20-,21-,22-,26-,27+,28-,29?/m0/s1
InChIKey YHGHLPGOUXMWLR-HYCKKXMNSA-N
Mol Weight 495.7 g/mol
Molecular Formula C29H37NO4S
Exact Mass 495.24433 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2CwYf8pWnEy
Name 2-[6-SPIRO-(3-BETA,17-BETA-DIACETOXYANDROST-4-ENYL)-4,5-BENZO-2[H]-THIAZOLE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H37NO4S
InChI InChI=1S/C29H37NO4S/c1-17(31)33-19-11-13-27(3)22-12-14-28(4)21(9-10-26(28)34-18(2)32)20(22)16-29(25(27)15-19)30-23-7-5-6-8-24(23)35-29/h5-8,15,19-22,26,30H,9-14,16H2,1-4H3/t19-,20-,21-,22-,26-,27+,28-,29?/m0/s1
InChIKey YHGHLPGOUXMWLR-HYCKKXMNSA-N
Literature Reference Author H.L.HOLLAND,S.KUMARESAN,G.LAKSHMAIAH
Literature Reference Citation CAN.J.CHEM.,73,2185(1995)
Literature Reference DOI 10.1139/v95-271
Molecular Weight 495.677 g/mol
Solvent CDCl3
Source File Reference UWCS15494