CID 83826162

2126161-52-0

Structural Information

Molecular Formula
C7H13N
SMILES
C1CC(C2C1C2)CN
InChI
InChI=1S/C7H13N/c8-4-6-2-1-5-3-7(5)6/h5-7H,1-4,8H2
InChIKey
LSWZVEBQLIJOJM-UHFFFAOYSA-N
Compound name
2-bicyclo[3.1.0]hexanylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

111.1048 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.112076 120.7
[M+Na]+ 134.094018 130.0
[M-H]- 110.097524 125.6
[M+NH4]+ 129.138623 141.0
[M+K]+ 150.067958 127.1
[M+H-H2O]+ 94.102060 115.7
[M+HCOO]- 156.103001 143.8
[M+CH3COO]- 170.118651 175.2
[M+Na-2H]- 132.079466 126.6
[M]+ 111.10425142 120.3
[M]- 111.10534858 120.3
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.