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]+ 112.11208 120.7
[M+Na]+ 134.09402 130.0
[M-H]- 110.09752 125.6
[M+NH4]+ 129.13862 141.0
[M+K]+ 150.06796 127.1
[M+H-H2O]+ 94.102060 115.7
[M+HCOO]- 156.10300 143.8
[M+CH3COO]- 170.11865 175.2
[M+Na-2H]- 132.07947 126.6
[M]+ 111.10425 120.3
[M]- 111.10535 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.