CID 94841706

2137600-94-1

Structural Information

Molecular Formula
C7H13N
SMILES
C1C[C@@H]2C[C@@]2(C1)CN
InChI
InChI=1S/C7H13N/c8-5-7-3-1-2-6(7)4-7/h6H,1-5,8H2/t6-,7+/m1/s1
InChIKey
FQNPNNZQNACGSV-RQJHMYQMSA-N
Compound name
[(1R,5R)-1-bicyclo[3.1.0]hexanyl]methanamine
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 121.9
[M+Na]+ 134.09402 131.1
[M-H]- 110.09752 126.9
[M+NH4]+ 129.13862 143.9
[M+K]+ 150.06796 129.0
[M+H-H2O]+ 94.102060 117.7
[M+HCOO]- 156.10300 144.8
[M+CH3COO]- 170.11865 173.7
[M+Na-2H]- 132.07947 129.4
[M]+ 111.10425 121.5
[M]- 111.10535 121.5
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.