CID 12714834

16001-27-7

Structural Information

Molecular Formula

SMILES

CC(C)(C)N=C(Cl)Cl

InChI

InChI=1S/C5H9Cl2N/c1-5(2,3)8-4(6)7/h1-3H3

InChIKey

GOMCNCRRMHUNQE-UHFFFAOYSA-N

Compound name

N-tert-butyl-1,1-dichloromethanimine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 153.0112 Da
Monoisotopic Mass: 2.9
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]+	154.01848	129.5
[M+Na]+	176.00042	138.5
[M-H]-	152.00392	131.1
[M+NH4]+	171.04502	152.6
[M+K]+	191.97436	135.6
[M+H-H2O]+	136.00846	127.2
[M+HCOO]-	198.00940	144.2
[M+CH3COO]-	212.02505	179.3
[M+Na-2H]-	173.98587	135.9
[M]+	153.01065	132.1
[M]-	153.01175	132.1

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.