CID 61437

Nitrogen trichloride

Structural Information

Molecular Formula

SMILES

N(Cl)(Cl)Cl

InChI

InChI=1S/Cl3N/c1-4(2)3

InChIKey

QEHKBHWEUPXBCW-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 92
References: 2961
Patents: 118.90963 Da
Monoisotopic Mass: 2.6
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]+	119.91691	114.2
[M+Na]+	141.89885	123.9
[M-H]-	117.90235	114.6
[M+NH4]+	136.94345	137.8
[M+K]+	157.87279	121.5
[M+H-H2O]+	101.90689	112.7
[M+HCOO]-	163.90783	126.0
[M+CH3COO]-	177.92348	172.6
[M+Na-2H]-	139.88430	121.4
[M]+	118.90908	115.8
[M]-	118.91018	115.8

Literature stripe

literature stripe

Patent stripe

patents stripe