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18-Norpregn-4-ene-3,20-dione, 13-ethyl-
SpectraBase Compound ID HgXbgbLe1JL
InChI InChI=1S/C22H32O2/c1-4-22-12-10-19-17(20(22)8-7-18(22)14(2)23)6-5-15-13-16(24)9-11-21(15,19)3/h13,17-20H,4-12H2,1-3H3/t17-,18-,19+,20+,21+,22-/m1/s1
InChIKey ZGAQJYYKGWWEEM-GPHILITQSA-N
Mol Weight 328.5 g/mol
Molecular Formula C22H32O2
Exact Mass 328.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I2el1LphSJ
Name 18-Norpregn-4-ene-3,20-dione, 13-ethyl-
Alternate Name(s) (1S,2R,10S,11S,14S,15S)-14-acetyl-15-ethyl-2-methyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-6-en-5-one 18-Methyl-progesterone (8S,9S,10R,13S,14S,17S)-17-ethanoyl-13-ethyl-10-methyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
CAS Registry Number 5895-84-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O2
InChI InChI=1S/C22H32O2/c1-4-22-12-10-19-17(20(22)8-7-18(22)14(2)23)6-5-15-13-16(24)9-11-21(15,19)3/h13,17-20H,4-12H2,1-3H3/t17-,18-,19+,20+,21+,22-/m1/s1
InChIKey ZGAQJYYKGWWEEM-GPHILITQSA-N
Molecular Weight 328.496 g/mol
SMILES [C@@]12([C@]([C@@]3(CCC=4[C@@]([C@]3(CC2)[H])(CCC(=O)C4)C)[H])(CC[C@@]1(C(=O)C)[H])[H])CC
SPLASH splash10-002f-9731000000-50dc6d7eceeeeac412c0
Source of Spectrum EP-1377-0-0
Wiley ID 1326769