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5α-Pregnan-3β,20β-diol diacetate

View entire compound with spectra: 1 NMR, 2 FTIR, and 1 Raman

5α-Pregnan-3β,20β-diol diacetate
SpectraBase Compound ID BOt0WQmefK
InChI InChI=1S/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18+,19+,20+,21-,22+,23+,24+,25-/m1/s1
InChIKey VDZDKQBSTYNFGG-ILKYCFRXSA-N
Mol Weight 404.6 g/mol
Molecular Formula C25H40O4
Exact Mass 404.29266 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FlL25kdFfiA
Name 5α-pregnane-3β,20β-diol, diacetate
Source of Sample M. L. LEWBART, CROZER-CHESTER MEDICAL CENTER, CHESTER, PENNSYLVANIA
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40O4
InChI InChI=1S/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18+,19+,20+,21-,22+,23+,24+,25-/m1/s1
InChIKey VDZDKQBSTYNFGG-ILKYCFRXSA-N
Molecular Weight 404.591003
Synonyms ALLOPREGNANE-3B,20B-DIOL, DIACETATE 5A-PREGNANE-3B,20B-DIOL, DIACETATE 5A-PREGNANE-3B,20B-DIOL, DIACETATE
Technique KBr WAFER