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Pregnan-3-ol
SpectraBase Compound ID ELpxEWYyDb8
InChI InChI=1S/C21H36O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h14-19,22H,4-13H2,1-3H3
InChIKey CEBZORSAHLSRQW-UHFFFAOYSA-N
Mol Weight 304.5 g/mol
Molecular Formula C21H36O
Exact Mass 304.276616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HAF9tGCk57Q
Name 3.BETA.-HYDROXY-5.ALPHA.-PREGNAN
Alternate Name(s) PREGNAN-3-OL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H36O
InChI InChI=1S/C21H36O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h14-19,22H,4-13H2,1-3H3
InChIKey CEBZORSAHLSRQW-UHFFFAOYSA-N
Nominal Mass 304 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC(O)CC2CCC2C1CCC1(C2CCC1CC)C
SPLASH splash10-0kai-9752000000-e35454537a28d16f0701
Source File Reference LMCM-11729-615Q
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany