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Androst-5-ene, 4,4-dimethyl-, (13.alpha.)-
SpectraBase Compound ID 4Wsw9KNpfxq
InChI InChI=1S/C21H34/c1-19(2)11-6-13-21(4)17-10-14-20(3)12-5-7-16(20)15(17)8-9-18(19)21/h9,15-17H,5-8,10-14H2,1-4H3/t15-,16-,17-,20+,21+/m0/s1
InChIKey RAYCKELWUDCADQ-XPKAMFKHSA-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 AKuMrd8OJI2
Name Androst-5-ene, 4,4-dimethyl-, (13.alpha.)-
Alternate Name(s) (13alpha)-4,4-dimethylandrost-5-ene 4,4-Dimethyl-13.alpha.-androst-5-ene
CAS Registry Number 73495-94-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34
InChI InChI=1S/C21H34/c1-19(2)11-6-13-21(4)17-10-14-20(3)12-5-7-16(20)15(17)8-9-18(19)21/h9,15-17H,5-8,10-14H2,1-4H3/t15-,16-,17-,20+,21+/m0/s1
InChIKey RAYCKELWUDCADQ-XPKAMFKHSA-N
Molecular Weight 286.503 g/mol
SMILES [C@]12(C(=CC[C@@]3([C@@]2(CC[C@]2(CCC[C@@]32[H])C)[H])[H])C(C)(C)CCC1)C
SPLASH splash10-00dr-0090000000-02eb8001453426e54e9c
Source of Spectrum H-62-2747-0
Wiley ID 1290512