CID 14088187

116577-08-3

Structural Information

Molecular Formula
C7H16N2
SMILES
CNC1(CCCC1)CN
InChI
InChI=1S/C7H16N2/c1-9-7(6-8)4-2-3-5-7/h9H,2-6,8H2,1H3
InChIKey
UAPBRGZWDDYYSW-UHFFFAOYSA-N
Compound name
1-(aminomethyl)-N-methylcyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

128.13135 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.138626 127.5
[M+Na]+ 151.120568 132.7
[M-H]- 127.124074 130.2
[M+NH4]+ 146.165173 152.3
[M+K]+ 167.094508 131.7
[M+H-H2O]+ 111.128610 122.5
[M+HCOO]- 173.129551 151.9
[M+CH3COO]- 187.145201 174.7
[M+Na-2H]- 149.106016 133.3
[M]+ 128.13080142 122.2
[M]- 128.13189858 122.2
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