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D-Homopregn-4-ene-3,15,20-trione
SpectraBase Compound ID GOnYWsGzNiX
InChI InChI=1S/C22H30O3/c1-13(23)17-6-7-19(25)20-16-5-4-14-12-15(24)8-10-21(14,2)18(16)9-11-22(17,20)3/h12,16-18,20H,4-11H2,1-3H3/t16?,17?,18?,20?,21-,22+/m0/s1
InChIKey YUFZEQUAGXLESS-PXJFBPCZSA-N
Mol Weight 342.48 g/mol
Molecular Formula C22H30O3
Exact Mass 342.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H3wojX0qbxn
Name D-Homopregn-4-ene-3,15,20-trione
CAS Registry Number 72921-04-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O3
InChI InChI=1S/C22H30O3/c1-13(23)17-6-7-19(25)20-16-5-4-14-12-15(24)8-10-21(14,2)18(16)9-11-22(17,20)3/h12,16-18,20H,4-11H2,1-3H3/t16?,17?,18?,20?,21-,22+/m0/s1
InChIKey YUFZEQUAGXLESS-PXJFBPCZSA-N
Molecular Weight 342.479 g/mol
SMILES [C@@]12(C(C3CCC=4[C@@](C3CC2)(CCC(=O)C4)C)C(=O)CCC1C(=O)C)C
SPLASH splash10-0006-4629000000-6cd68f0e062e8030c9d6
Source of Spectrum K-113-218-0
Synonyms (4aR,6aR)-7-acetyl-4a,6a-dimethyl-3,4,4a,4b,5,6,6a,7,8,9,10a,10b,11,12-tetradecahydro-2,10-chrysenedione D-homo-4-pregnen-3,15,20-trione
Wiley ID 1336927