CID 67772

366-71-2

Structural Information

Molecular Formula

C₁₀H₁₄N₄O₂

SMILES

CNNCC1=CC=C(C=C1)C(=O)NC(=O)N

InChI

InChI=1S/C10H14N4O2/c1-12-13-6-7-2-4-8(5-3-7)9(15)14-10(11)16/h2-5,12-13H,6H2,1H3,(H3,11,14,15,16)

InChIKey

WDFBRASOOZFGHK-UHFFFAOYSA-N

Compound name

N-carbamoyl-4-[(2-methylhydrazinyl)methyl]benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 222.11168 Da
Monoisotopic Mass: -1.0
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]+	223.118956	148.5
[M+Na]+	245.100898	153.0
[M-H]-	221.104404	151.7
[M+NH4]+	240.145503	165.0
[M+K]+	261.074838	151.5
[M+H-H2O]+	205.108940	140.9
[M+HCOO]-	267.109881	174.9
[M+CH3COO]-	281.125531	198.2
[M+Na-2H]-	243.086346	153.1
[M]+	222.11113142	145.1
[M]-	222.11222858	145.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe