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Pregesterone
SpectraBase Compound ID 2PysdQqzjJY
InChI InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3
InChIKey RJKFOVLPORLFTN-UHFFFAOYSA-N
Mol Weight 314.47 g/mol
Molecular Formula C21H30O2
Exact Mass 314.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnaSEXQisjC
Name PREGN-4-ENE-3,20-DIONE, 11-HYDROXY-, (11alpha)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3
InChIKey RJKFOVLPORLFTN-UHFFFAOYSA-N
Instrument Name CH5
Molecular Weight 314.2238
SMILES C1(=O)C=C2CCC3C4CCC(C(=O)C)C4(C)CCC3C2(C)CC1
SPLASH splash10-006x-6921000000-cd7469b458ca57d6d61c
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany