CID 14606066

6-hydroxyfenchone

Structural Information

Molecular Formula
C10H16O2
SMILES
CC1(C2CC(C(C2)(C1=O)C)O)C
InChI
InChI=1S/C10H16O2/c1-9(2)6-4-7(11)10(3,5-6)8(9)12/h6-7,11H,4-5H2,1-3H3
InChIKey
RBJVDSYEMJHFOC-UHFFFAOYSA-N
Compound name
6-hydroxy-1,3,3-trimethylbicyclo[2.2.1]heptan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.11504 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.12232 135.8
[M+Na]+ 191.10426 145.9
[M-H]- 167.10776 138.3
[M+NH4]+ 186.14886 165.4
[M+K]+ 207.07820 143.1
[M+H-H2O]+ 151.11230 134.2
[M+HCOO]- 213.11324 155.8
[M+CH3COO]- 227.12889 177.9
[M+Na-2H]- 189.08971 140.2
[M]+ 168.11449 136.1
[M]- 168.11559 136.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.