CID 19105389

104845-82-1

Structural Information

Molecular Formula

C₃H₁₀N₂O₂

SMILES

C(CON)CON

InChI

InChI=1S/C3H10N2O2/c4-6-2-1-3-7-5/h1-5H2

InChIKey

COEBNIUQBHSRFT-UHFFFAOYSA-N

Compound name

O-(3-aminooxypropyl)hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 126
Patents: 106.07423 Da
Monoisotopic Mass: -1.2
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]+	107.08151	118.6
[M+Na]+	129.06345	125.3
[M-H]-	105.06695	118.1
[M+NH4]+	124.10805	140.4
[M+K]+	145.03739	125.9
[M+H-H2O]+	89.071490	113.4
[M+HCOO]-	151.07243	144.6
[M+CH3COO]-	165.08808	170.4
[M+Na-2H]-	127.04890	125.5
[M]+	106.07368	117.9
[M]-	106.07478	117.9

Literature stripe

literature stripe

Patent stripe

patents stripe