CID 14235023

(3-methylpyrrolidin-3-yl)methanamine dihydrochloride

Structural Information

Molecular Formula
C6H14N2
SMILES
CC1(CCNC1)CN
InChI
InChI=1S/C6H14N2/c1-6(4-7)2-3-8-5-6/h8H,2-5,7H2,1H3
InChIKey
APRDXQSALZYCME-UHFFFAOYSA-N
Compound name
(3-methylpyrrolidin-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

47
Patents

114.1157 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.122976 124.8
[M+Na]+ 137.104918 130.9
[M-H]- 113.108424 124.9
[M+NH4]+ 132.149523 148.5
[M+K]+ 153.078858 129.3
[M+H-H2O]+ 97.112960 119.6
[M+HCOO]- 159.113901 145.7
[M+CH3COO]- 173.129551 166.8
[M+Na-2H]- 135.090366 130.2
[M]+ 114.11515142 118.5
[M]- 114.11624858 118.5
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

patents stripe