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D-Homopregna-1,4-diene-3,12,15,20-tetrone
SpectraBase Compound ID 6zMx8zW4pB9
InChI InChI=1S/C22H26O4/c1-12(23)13-8-18(25)20-16-5-4-14-9-15(24)6-7-21(14,2)17(16)10-19(26)22(20,3)11-13/h6-7,9,13,16-17,20H,4-5,8,10-11H2,1-3H3
InChIKey LQQRVEWWBQKVIE-UHFFFAOYSA-N
Mol Weight 354.45 g/mol
Molecular Formula C22H26O4
Exact Mass 354.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DLh4RUdqO9f
Name D-Homopregna-1,4-diene-3,12,15,20-tetrone
Alternate Name(s) 8-Acetyl-4a,6a-dimethyl-4b,5,6a,7,8,9,10a,10b,11,12-decahydro-2,6,10(4aH)-chrysenetrione D-homo-1,4-pregnadien-3,12,15,20-tetraone
CAS Registry Number 72921-19-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O4
InChI InChI=1S/C22H26O4/c1-12(23)13-8-18(25)20-16-5-4-14-9-15(24)6-7-21(14,2)17(16)10-19(26)22(20,3)11-13/h6-7,9,13,16-17,20H,4-5,8,10-11H2,1-3H3
InChIKey LQQRVEWWBQKVIE-UHFFFAOYSA-N
Molecular Weight 354.446 g/mol
SMILES C12(C(C3CCC=4C(C3CC2=O)(C=CC(=O)C4)C)C(=O)CC(C1)C(=O)C)C
SPLASH splash10-00e9-1693000000-ecbdf01f4dc96916a160
Source of Spectrum K-113-219-0
Wiley ID 1344850