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(-)-3β-hydroxyandrost-5-ene-17β-carboxylic acid, acetate
SpectraBase Compound ID 6wDAOtqNvAa
InChI InChI=1S/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/t15-,16-,17-,18-,19+,21-,22-/m0/s1
InChIKey WVHKCBDRQIXZLC-SPHVDITISA-N
Mol Weight 360.5 g/mol
Molecular Formula C22H32O4
Exact Mass 360.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7YRrkkWZUUB
Name (-)-3β-hydroxyandrost-5-ene-17β-carboxylic acid, acetate
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 51424-66-9
Comments Some carbon atoms are unassigned; Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O4
InChI InChI=1S/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/t15-,16-,17-,18-,19+,21-,22-/m0/s1
InChIKey WVHKCBDRQIXZLC-SPHVDITISA-N
Melting Point 238-240C
Molecular Weight 360.50
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20