CID 18712661

1-(1,3-dimethyl-3-pyrrolidinyl)methanamine

Structural Information

Molecular Formula
C7H16N2
SMILES
CC1(CCN(C1)C)CN
InChI
InChI=1S/C7H16N2/c1-7(5-8)3-4-9(2)6-7/h3-6,8H2,1-2H3
InChIKey
HBEGEQPEVWXGGD-UHFFFAOYSA-N
Compound name
(1,3-dimethylpyrrolidin-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
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 127.9
[M+Na]+ 151.120568 134.9
[M-H]- 127.124074 129.6
[M+NH4]+ 146.165173 152.1
[M+K]+ 167.094508 134.0
[M+H-H2O]+ 111.128610 122.6
[M+HCOO]- 173.129551 150.0
[M+CH3COO]- 187.145201 173.6
[M+Na-2H]- 149.106016 132.6
[M]+ 128.13080142 124.2
[M]- 128.13189858 124.2
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