CID 7020624

N-methylcyclopentanamine hydrochloride

Structural Information

Molecular Formula
C6H13N
SMILES
CNC1CCCC1
InChI
InChI=1S/C6H13N/c1-7-6-4-2-3-5-6/h6-7H,2-5H2,1H3
InChIKey
KKTBUCVHSCATGB-UHFFFAOYSA-N
Compound name
N-methylcyclopentanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

3666
Patents

99.1048 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.11208 120.6
[M+Na]+ 122.09402 126.2
[M-H]- 98.097524 123.7
[M+NH4]+ 117.13862 145.1
[M+K]+ 138.06796 125.7
[M+H-H2O]+ 82.102060 115.4
[M+HCOO]- 144.10300 144.9
[M+CH3COO]- 158.11865 168.0
[M+Na-2H]- 120.07947 126.4
[M]+ 99.104251 116.4
[M]- 99.105349 116.4
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