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beta-NORANDROST-4-ENE-3,6-DIONE, 17beta-HYDROXY-, BENZOATE
SpectraBase Compound ID AuxykAaJ5Nz
InChI InChI=1S/C25H28O4/c1-24-12-10-16(26)14-19(24)22(27)21-17-8-9-20(25(17,2)13-11-18(21)24)29-23(28)15-6-4-3-5-7-15/h3-7,14,17-18,20-21H,8-13H2,1-2H3
InChIKey ZJGWGYNRXILVNG-UHFFFAOYSA-N
Mol Weight 392.5 g/mol
Molecular Formula C25H28O4
Exact Mass 392.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7lpP7ur0bfy
Name beta-NORANDROST-4-ENE-3,6-DIONE, 17beta-HYDROXY-, BENZOATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H28O4
InChI InChI=1S/C25H28O4/c1-24-12-10-16(26)14-19(24)22(27)21-17-8-9-20(25(17,2)13-11-18(21)24)29-23(28)15-6-4-3-5-7-15/h3-7,14,17-18,20-21H,8-13H2,1-2H3
InChIKey ZJGWGYNRXILVNG-UHFFFAOYSA-N
Molecular Weight 392.1980
SMILES C1CC2(C)C3CCC4(C)C(OC(c5ccccc5)=O)CCC4C3C(=O)C2=CC1=O
SPLASH splash10-0a4i-4930000000-e827ee597ab29ec0c50b
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany