CID 12425703

3-phenoxypropanehydrazide

Structural Information

Molecular Formula

C₉H₁₂N₂O₂

SMILES

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

InChI

InChI=1S/C9H12N2O2/c10-11-9(12)6-7-13-8-4-2-1-3-5-8/h1-5H,6-7,10H2,(H,11,12)

InChIKey

WRHSYZCXIFCBHI-UHFFFAOYSA-N

Compound name

3-phenoxypropanehydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 39
Patents: 180.08987 Da
Monoisotopic Mass: 0.5
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	138.7
[M+Na]+	203.07909	148.5
[M+NH4]+	198.12369	146.1
[M+K]+	219.05303	143.2
[M-H]-	179.08259	140.9
[M+Na-2H]-	201.06454	144.9
[M]+	180.08932	140.3
[M]-	180.09042	140.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe