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Androstane-3,7,17-triol

View entire compound with spectra: 1 FTIR, and 6 MS (GC)

Androstane-3,7,17-triol
SpectraBase Compound ID ByP8SM1FPC
InChI InChI=1S/C19H32O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h11-17,20-22H,3-10H2,1-2H3
InChIKey UFGLFVVFQFFPSV-UHFFFAOYSA-N
Mol Weight 308.5 g/mol
Molecular Formula C19H32O3
Exact Mass 308.235145 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6hYB5Dluadu
Name 5.alpha.-Androstane-3.beta.,7.beta.,17.beta.-triol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.235144887 u
Formula C19H32O3
InChI InChI=1S/C19H32O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h11-17,20-22H,3-10H2,1-2H3
InChIKey UFGLFVVFQFFPSV-UHFFFAOYSA-N
Molecular Weight 308.462 g/mol
SMILES C12C(C3CCC(C3(CC2)C)O)C(CC2C1(CCC(O)C2)C)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.820211