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14-.beta.-H-pregna
SpectraBase Compound ID CB3L7TJbKfw
InChI InChI=1S/C21H36/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/h15-19H,4-14H2,1-3H3/t15-,16?,17-,18+,19-,20-,21+/m0/s1
InChIKey JWMFYGXQPXQEEM-TVYRZLTBSA-N
Mol Weight 288.5 g/mol
Molecular Formula C21H36
Exact Mass 288.281701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ZKhJfKu07L
Name 14-.beta.-H-pregna
Alternate Name(s) (14beta)-pregnane 14-.beta.-pregna 14b-pregnane
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Formula C21H36
InChI InChI=1S/C21H36/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/h15-19H,4-14H2,1-3H3/t15-,16?,17-,18+,19-,20-,21+/m0/s1
InChIKey JWMFYGXQPXQEEM-TVYRZLTBSA-N
Molecular Weight 288.519 g/mol
SMILES [C@@]12([C@@]([C@@]3(CCC4[C@]([C@]3(CC2)[H])(C)CCCC4)[H])(CC[C@@]1(CC)[H])[H])C
SPLASH splash10-0a5a-9410000000-2515480056326c130948
Source of Spectrum SD-1992-0-0
Wiley ID 1292357