CID 14752702

6-dehydronandrolone

Structural Information

Molecular Formula
C18H24O2
SMILES
CC12CCC3C4CCC(=O)C=C4C=CC3C1CCC2O
InChI
InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2,4,10,13-17,20H,3,5-9H2,1H3
InChIKey
HFLHHQWDPZNOPI-UHFFFAOYSA-N
Compound name
17-hydroxy-13-methyl-2,8,9,10,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

272.17764 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.18492 165.8
[M+Na]+ 295.16686 176.4
[M+NH4]+ 290.21146 177.6
[M+K]+ 311.14080 168.5
[M-H]- 271.17036 168.8
[M+Na-2H]- 293.15231 168.2
[M]+ 272.17709 168.2
[M]- 272.17819 168.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.