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De-A,B-22-oxo-23,24-dinor-20-epi-cholestan-8-one
SpectraBase Compound ID JeQYnPJYnv0
InChI InChI=1S/C13H20O2/c1-9-3-5-13(10(2)8-14)6-4-11(15)7-12(9)13/h8-10,12H,3-7H2,1-2H3/t9-,10?,12?,13?/m1/s1
InChIKey CJGMXGGOOVYLNU-QMDOVSTPSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KxRzZvV68
Name De-A,B-22-oxo-23,24-dinor-20-epi-cholestan-8-one
Alternate Name(s) 1-(1'-Formylethyl)-4-oxo-7a-methylbicyclo[4.3.0]nonane 2-[(1R)-1-methyl-6-oxooctahydro-3aH-inden-3a-yl]propanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-9-3-5-13(10(2)8-14)6-4-11(15)7-12(9)13/h8-10,12H,3-7H2,1-2H3/t9-,10?,12?,13?/m1/s1
InChIKey CJGMXGGOOVYLNU-QMDOVSTPSA-N
Molecular Weight 208.301 g/mol
SMILES C12(C(CC(CC2)=O)[C@](C)(CC1)[H])C(C=O)C
SPLASH splash10-06rx-9400000000-892d9ed1cea6633ba788
Source of Spectrum U1-1999-2245-18
Wiley ID 753795