CID 69832

1-chloronorbornane

Structural Information

Molecular Formula
C7H11Cl
SMILES
C1CC2(CCC1C2)Cl
InChI
InChI=1S/C7H11Cl/c8-7-3-1-6(5-7)2-4-7/h6H,1-5H2
InChIKey
LKMFWORXBTXJNB-UHFFFAOYSA-N
Compound name
1-chlorobicyclo[2.2.1]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

76
Patents

130.05493 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.06221 129.6
[M+Na]+ 153.04415 138.2
[M-H]- 129.04765 132.3
[M+NH4]+ 148.08875 159.3
[M+K]+ 169.01809 134.7
[M+H-H2O]+ 113.05219 126.5
[M+HCOO]- 175.05313 146.8
[M+CH3COO]- 189.06878 143.9
[M+Na-2H]- 151.02960 135.1
[M]+ 130.05438 128.4
[M]- 130.05548 128.4
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

patents stripe