CID 317734

2-(phenylamino)acetohydrazide

Structural Information

Molecular Formula

C₈H₁₁N₃O

SMILES

C1=CC=C(C=C1)NCC(=O)NN

InChI

InChI=1S/C8H11N3O/c9-11-8(12)6-10-7-4-2-1-3-5-7/h1-5,10H,6,9H2,(H,11,12)

InChIKey

WKELCSMVLKMMAH-UHFFFAOYSA-N

Compound name

2-anilinoacetohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 90
Patents: 165.09021 Da
Monoisotopic Mass: 0.2
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]+	166.09749	133.3
[M+Na]+	188.07943	138.6
[M-H]-	164.08293	136.4
[M+NH4]+	183.12403	152.4
[M+K]+	204.05337	136.8
[M+H-H2O]+	148.08747	126.5
[M+HCOO]-	210.08841	160.0
[M+CH3COO]-	224.10406	183.9
[M+Na-2H]-	186.06488	140.6
[M]+	165.08966	129.5
[M]-	165.09076	129.5

Literature stripe

literature stripe

Patent stripe

patents stripe