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3,17-diketo-4,4,13-trimethyl-1,2,5,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-10-carboxylic acid
SpectraBase Compound ID 1Wt6L8x1utm
InChI InChI=1S/C21H30O4/c1-19(2)15-6-4-12-13-5-7-17(23)20(13,3)10-8-14(12)21(15,18(24)25)11-9-16(19)22/h12-15H,4-11H2,1-3H3,(H,24,25)
InChIKey SLROTJYGPHGJGI-UHFFFAOYSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fsb9s353O1V
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-19(2)15-6-4-12-13-5-7-17(23)20(13,3)10-8-14(12)21(15,18(24)25)11-9-16(19)22/h12-15H,4-11H2,1-3H3,(H,24,25)
InChIKey SLROTJYGPHGJGI-UHFFFAOYSA-N
Molecular Weight 346.2136
SMILES OC(=O)C12C(CCC3C4CCC(=O)C4(C)CCC13)C(C)(C)C(=O)CC2
SPLASH splash10-0002-8965000000-ef75f77d2e2ac18a175e
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany