CID 607111

29043-58-1

Structural Information

Molecular Formula

C₁₅H₁₃ClN₂O

SMILES

C1=CC=C(C=C1)C(=NNC(=O)CCl)C2=CC=CC=C2

InChI

InChI=1S/C15H13ClN2O/c16-11-14(19)17-18-15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10H,11H2,(H,17,19)

InChIKey

FOGMNOHCZQDZGD-UHFFFAOYSA-N

Compound name

N-(benzhydrylideneamino)-2-chloroacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 1
Patents: 272.07166 Da
Monoisotopic Mass: 3.7
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]+	273.07894	162.1
[M+Na]+	295.06088	175.6
[M+NH4]+	290.10548	170.8
[M+K]+	311.03482	167.0
[M-H]-	271.06438	167.7
[M+Na-2H]-	293.04633	172.1
[M]+	272.07111	165.8
[M]-	272.07221	165.8

Literature stripe

literature stripe

Patent stripe

patents stripe