CID 138701

Fenchane

Structural Information

Molecular Formula
C10H18
SMILES
CC1(CC2(CCC1C2)C)C
InChI
InChI=1S/C10H18/c1-9(2)7-10(3)5-4-8(9)6-10/h8H,4-7H2,1-3H3
InChIKey
HINAOCRDJFBYGD-UHFFFAOYSA-N
Compound name
1,3,3-trimethylbicyclo[2.2.1]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

2819
Patents

138.14085 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.148126 132.8
[M+Na]+ 161.130068 141.4
[M-H]- 137.133574 136.1
[M+NH4]+ 156.174673 163.9
[M+K]+ 177.104008 139.1
[M+H-H2O]+ 121.138110 129.9
[M+HCOO]- 183.139051 153.8
[M+CH3COO]- 197.154701 175.3
[M+Na-2H]- 159.115516 138.1
[M]+ 138.14030142 131.8
[M]- 138.14139858 131.8
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.