CID 53929122

Pyrrolidine-2-carboximidamide dihydrochloride

Structural Information

Molecular Formula
C5H11N3
SMILES
C1CC(NC1)C(=N)N
InChI
InChI=1S/C5H11N3/c6-5(7)4-2-1-3-8-4/h4,8H,1-3H2,(H3,6,7)
InChIKey
SYERHLYFHUKCKP-UHFFFAOYSA-N
Compound name
pyrrolidine-2-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

42
Patents

113.0953 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.10258 123.9
[M+Na]+ 136.08452 128.6
[M-H]- 112.08802 123.8
[M+NH4]+ 131.12912 144.9
[M+K]+ 152.05846 126.9
[M+H-H2O]+ 96.092560 117.4
[M+HCOO]- 158.09350 145.2
[M+CH3COO]- 172.10915 169.1
[M+Na-2H]- 134.06997 127.7
[M]+ 113.09475 114.8
[M]- 113.09585 114.8
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