CID 418800

98280-67-2

Structural Information

Molecular Formula
C6H12ClN
SMILES
C1CCC(C(C1)N)Cl
InChI
InChI=1S/C6H12ClN/c7-5-3-1-2-4-6(5)8/h5-6H,1-4,8H2
InChIKey
RTZWBJIYBWNJMR-UHFFFAOYSA-N
Compound name
2-chlorocyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

67
Patents

133.06583 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.07311 127.1
[M+Na]+ 156.05505 133.4
[M-H]- 132.05855 129.5
[M+NH4]+ 151.09965 149.2
[M+K]+ 172.02899 130.5
[M+H-H2O]+ 116.06309 122.8
[M+HCOO]- 178.06403 144.0
[M+CH3COO]- 192.07968 172.4
[M+Na-2H]- 154.04050 131.8
[M]+ 133.06528 122.0
[M]- 133.06638 122.0
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

patents stripe