CID 1519366

(3r)-pyrrolidin-3-ylmethanamine

Structural Information

Molecular Formula
C5H12N2
SMILES
C1CNC[C@H]1CN
InChI
InChI=1S/C5H12N2/c6-3-5-1-2-7-4-5/h5,7H,1-4,6H2/t5-/m1/s1
InChIKey
OQCUGPQOZNYIMV-RXMQYKEDSA-N
Compound name
[(3R)-pyrrolidin-3-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

958
Patents

100.10005 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 101.10733 121.0
[M+Na]+ 123.08927 126.6
[M-H]- 99.092774 120.9
[M+NH4]+ 118.13387 143.2
[M+K]+ 139.06321 125.1
[M+H-H2O]+ 83.097310 115.0
[M+HCOO]- 145.09825 142.2
[M+CH3COO]- 159.11390 164.2
[M+Na-2H]- 121.07472 125.8
[M]+ 100.09950 114.1
[M]- 100.10060 114.1
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