CID 136177

353-07-1

Structural Information

Molecular Formula

C₃H₇N₃

SMILES

C(CNN)C#N

InChI

InChI=1S/C3H7N3/c4-2-1-3-6-5/h6H,1,3,5H2

InChIKey

VIHRIIARIFUQLC-UHFFFAOYSA-N

Compound name

3-hydrazinylpropanenitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 670
Patents: 85.063995 Da
Monoisotopic Mass: -1.3
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]+	86.071271	114.9
[M+Na]+	108.05321	123.2
[M-H]-	84.056719	115.5
[M+NH4]+	103.09782	135.5
[M+K]+	124.02715	123.5
[M+H-H2O]+	68.061255	103.6
[M+HCOO]-	130.06220	137.2
[M+CH3COO]-	144.07785	182.0
[M+Na-2H]-	106.03866	122.5
[M]+	85.063446	107.7
[M]-	85.064544	107.7

Literature stripe

literature stripe

Patent stripe

patents stripe