CID 117295

2-(aminomethyl)-1-ethylpyrrolidine

Structural Information

Molecular Formula
C7H16N2
SMILES
CCN1CCCC1CN
InChI
InChI=1S/C7H16N2/c1-2-9-5-3-4-7(9)6-8/h7H,2-6,8H2,1H3
InChIKey
UNRBEYYLYRXYCG-UHFFFAOYSA-N
Compound name
(1-ethylpyrrolidin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

2093
Patents

128.13135 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.13863 129.4
[M+Na]+ 151.12057 135.5
[M-H]- 127.12407 130.6
[M+NH4]+ 146.16517 151.5
[M+K]+ 167.09451 134.4
[M+H-H2O]+ 111.12861 123.1
[M+HCOO]- 173.12955 151.4
[M+CH3COO]- 187.14520 174.0
[M+Na-2H]- 149.10602 132.8
[M]+ 128.13080 125.4
[M]- 128.13190 125.4
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