CID 215800

2-(3-methylphenoxy)acetohydrazide

Structural Information

Molecular Formula

C₉H₁₂N₂O₂

SMILES

CC1=CC(=CC=C1)OCC(=O)NN

InChI

InChI=1S/C9H12N2O2/c1-7-3-2-4-8(5-7)13-6-9(12)11-10/h2-5H,6,10H2,1H3,(H,11,12)

InChIKey

XTTHKVPUJUYDDK-UHFFFAOYSA-N

Compound name

2-(3-methylphenoxy)acetohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 5
Patents: 180.08987 Da
Monoisotopic Mass: 0.8
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]+	181.09715	138.4
[M+Na]+	203.07909	148.6
[M+NH4]+	198.12369	145.9
[M+K]+	219.05303	143.5
[M-H]-	179.08259	140.7
[M+Na-2H]-	201.06454	144.4
[M]+	180.08932	140.2
[M]-	180.09042	140.2

Literature stripe

literature stripe

Patent stripe

patents stripe