16-[(1,5-dimethyl-1H-pyrazol-4-yl)methylene]-3-hydroxyandrost-5-en-17-one

SpectraBase Compound ID	HdyU12ntSm3
InChI	InChI=1S/C25H34N2O2/c1-15-17(14-26-27(15)4)11-16-12-22-20-6-5-18-13-19(28)7-9-24(18,2)21(20)8-10-25(22,3)23(16)29/h5,11,14,19-22,28H,6-10,12-13H2,1-4H3/b16-11-
InChIKey	WKIGFFFJAUQISK-WJDWOHSUSA-N Google Search
Mol Weight	394.6 g/mol
Molecular Formula	C25H34N2O2
Exact Mass	394.262028 g/mol

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SpectraBase Spectrum ID	Desobp4Ght3
Name	16-[(1,5-Dimethyl-1H-pyrazol-4-yl)methylene]-3-hydroxyandrost-5-en-17-one
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	394.262028341 u
Formula	C25H34N2O2
InChI	InChI=1S/C25H34N2O2/c1-15-17(14-26-27(15)4)11-16-12-22-20-6-5-18-13-19(28)7-9-24(18,2)21(20)8-10-25(22,3)23(16)29/h5,11,14,19-22,28H,6-10,12-13H2,1-4H3/b16-11-
InChIKey	WKIGFFFJAUQISK-WJDWOHSUSA-N
Molecular Weight	394.559 g/mol
SMILES	OC1CCC2(C3CCC4(C(C3CC=C2C1)C\C(C4=O)=C\C1=C(N(C)N=C1)C)C)C