CID 2794597

49755-46-6

Structural Information

Molecular Formula

C₅H₁₁N₃

SMILES

C1CCN(C1)C(=N)N

InChI

InChI=1S/C5H11N3/c6-5(7)8-3-1-2-4-8/h1-4H2,(H3,6,7)

InChIKey

PIGIRWPZTWLVLB-UHFFFAOYSA-N

Compound name

pyrrolidine-1-carboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 297
Patents: 113.0953 Da
Monoisotopic Mass: -0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	114.10258	123.6
[M+Na]+	136.08452	128.9
[M-H]-	112.08802	125.0
[M+NH4]+	131.12912	145.5
[M+K]+	152.05846	128.1
[M+H-H2O]+	96.092560	117.0
[M+HCOO]-	158.09350	146.5
[M+CH3COO]-	172.10915	170.9
[M+Na-2H]-	134.06997	127.9
[M]+	113.09475	116.3
[M]-	113.09585	116.3

Literature stripe

literature stripe

Patent stripe

patents stripe