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]+ 129.13863 127.9
[M+Na]+ 151.12057 134.9
[M-H]- 127.12407 129.6
[M+NH4]+ 146.16517 152.1
[M+K]+ 167.09451 134.0
[M+H-H2O]+ 111.12861 122.6
[M+HCOO]- 173.12955 150.0
[M+CH3COO]- 187.14520 173.6
[M+Na-2H]- 149.10602 132.6
[M]+ 128.13080 124.2
[M]- 128.13190 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