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CYCLOPENTANE-1'-SPIRO-5-(7BETA-ACETOXY-19-BROMO-7A-HOMO-DES-A-CHOLESTAN-6-ONE)
SpectraBase Compound ID 9bg6t4zwf3p
InChI InChI=1S/C30H49BrO3/c1-19(2)9-8-10-20(3)24-11-12-25-23-17-27(34-21(4)32)28(33)30(14-6-7-15-30)26(18-31)22(23)13-16-29(24,25)5/h19-20,22-27H,6-18H2,1-5H3/t20?,22?,23?,24?,25?,26-,27+,29+/m1/s1
InChIKey WJUCWIQVJZKXAH-ZKFJDKJESA-N
Mol Weight 537.6 g/mol
Molecular Formula C30H49BrO3
Exact Mass 536.286508 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B6lkUSjr6T5
Name CYCLOPENTANE-1'-SPIRO-5-(7BETA-ACETOXY-19-BROMO-7A-HOMO-DES-A-CHOLESTAN-6-ONE)
Comments NiX
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C30H49BrO3
InChI InChI=1S/C30H49BrO3/c1-19(2)9-8-10-20(3)24-11-12-25-23-17-27(34-21(4)32)28(33)30(14-6-7-15-30)26(18-31)22(23)13-16-29(24,25)5/h19-20,22-27H,6-18H2,1-5H3/t20?,22?,23?,24?,25?,26-,27+,29+/m1/s1
InChIKey WJUCWIQVJZKXAH-ZKFJDKJESA-N
Instrument Name Varian XL-200
Literature Reference P.KOCOVSKY, F.TURECEK (1981) Coll.Czech.Chem.Comm.: v.46, N11, 2877-2891.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d