CID 40479342

2172607-40-6

Structural Information

Molecular Formula

C₅H₁₁N₃O

SMILES

C1CCN(C1)/C(=N/O)/N

InChI

InChI=1S/C5H11N3O/c6-5(7-9)8-3-1-2-4-8/h9H,1-4H2,(H2,6,7)

InChIKey

YVUUTZVRHZMHKM-UHFFFAOYSA-N

Compound name

N'-hydroxypyrrolidine-1-carboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1
Patents: 129.09021 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]+	130.09749	126.5
[M+Na]+	152.07943	131.7
[M-H]-	128.08293	127.9
[M+NH4]+	147.12403	147.8
[M+K]+	168.05337	131.4
[M+H-H2O]+	112.08747	119.7
[M+HCOO]-	174.08841	149.7
[M+CH3COO]-	188.10406	172.4
[M+Na-2H]-	150.06488	130.8
[M]+	129.08966	120.6
[M]-	129.09076	120.6

Literature stripe

literature stripe

Patent stripe

patents stripe