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6-Methyl-pregn-4,16-dien-3,20-dione
SpectraBase Compound ID BDwO00PN8va
InChI InChI=1S/C22H30O2/c1-13-11-16-18-6-5-17(14(2)23)21(18,3)10-8-19(16)22(4)9-7-15(24)12-20(13)22/h5,12-13,16,18-19H,6-11H2,1-4H3/t13?,16-,18-,19-,21+,22+/m0/s1
InChIKey OYKZZOBOZGNJRB-OICVQFCSSA-N
Mol Weight 326.48 g/mol
Molecular Formula C22H30O2
Exact Mass 326.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 48E0j5yxcmJ
Name 6-Methyl-pregn-4,16-dien-3,20-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O2
InChI InChI=1S/C22H30O2/c1-13-11-16-18-6-5-17(14(2)23)21(18,3)10-8-19(16)22(4)9-7-15(24)12-20(13)22/h5,12-13,16,18-19H,6-11H2,1-4H3/t13?,16-,18-,19-,21+,22+/m0/s1
InChIKey OYKZZOBOZGNJRB-OICVQFCSSA-N
Molecular Weight 326.480 g/mol
SMILES [C@@]12(C(=CC(CC2)=O)C(C)C[C@@]2([C@@]1(CC[C@@]1(C(C(=O)C)=CC[C@@]21[H])C)[H])[H])C
SPLASH splash10-003i-1936000000-dfc863d9d75b4427cfe6
Source of Spectrum CJ-1992-0-0
Synonyms 6-Methylpregna-4,16-diene-3,20-dione
Wiley ID 1325230