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Pregn-14-ene, (5.beta.)-
SpectraBase Compound ID 5VAARi9besW
InChI InChI=1S/C21H34/c1-4-15-9-11-18-17-10-8-16-7-5-6-13-20(16,2)19(17)12-14-21(15,18)3/h11,15-17,19H,4-10,12-14H2,1-3H3
InChIKey YPTUHKNMMRPURM-UHFFFAOYSA-N
Mol Weight 286.5 g/mol
Molecular Formula C21H34
Exact Mass 286.266051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JC3sr6xc4dX
Name Pregn-14-ene, (5.beta.)-
Alternate Name(s) Pregn-14-ene 17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
CAS Registry Number 54411-80-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34
InChI InChI=1S/C21H34/c1-4-15-9-11-18-17-10-8-16-7-5-6-13-20(16,2)19(17)12-14-21(15,18)3/h11,15-17,19H,4-10,12-14H2,1-3H3
InChIKey YPTUHKNMMRPURM-UHFFFAOYSA-N
Molecular Weight 286.503 g/mol
SMILES CC12C3C(C=4C(CC3)(C)C(CC)CC4)CCC2CCCC1
SPLASH splash10-0a4i-9650000000-1c1aab020fe6b56dd459
Source of Spectrum SD-1981-0-0
Wiley ID 1290503