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Pregnenolone sulfate, sodium salt
SpectraBase Compound ID ASCXhcpfKHJ
InChI InChI=1S/C21H32O5S.Na/c1-13(22)17-6-7-18-16-5-4-14-12-15(26-27(23,24)25)8-10-20(14,2)19(16)9-11-21(17,18)3;/h4,15-19H,5-12H2,1-3H3,(H,23,24,25);/q;+1/p-1/t15-,16-,17+,18-,19-,20-,21+;/m0./s1
InChIKey QQVJEIZJHDPTSH-UTNKIXDHSA-M
Mol Weight 418.52376928 g/mol
Molecular Formula C21H31NaO5S
Exact Mass 418.17899 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 8HwOp50BLlf
Name Pregnenolone sulfate, sodium salt
Source of Sample Steraloids Inc.
Catalog Number Q5545-000
Lot Number B0355
CAS Registry Number 1852-38-6
Classification progesterone type
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Formula C21H31NaO5S
InChI InChI=1S/C21H32O5S.Na/c1-13(22)17-6-7-18-16-5-4-14-12-15(26-27(23,24)25)8-10-20(14,2)19(16)9-11-21(17,18)3;/h4,15-19H,5-12H2,1-3H3,(H,23,24,25);/q;+1/p-1/t15-,16-,17+,18-,19-,20-,21+;/m0./s1
InChIKey QQVJEIZJHDPTSH-UTNKIXDHSA-M
Melting Point 180.0 - 182.0 °C
Raman Corrections Referenced to internal white light source; 180 Degree backscatter
Raman Laser Source Nd:YAG
Source of Spectrum Forensic Spectral Research
Synonyms 5-Pregnen-3b-ol-20-one sulfate, sodium salt; 3b-Hydroxy-5-pregnen-20-one 3-sulfate
Technique FT-Raman