CID 3040075

51628-11-6

Structural Information

Molecular Formula

C₁₀H₁₃ClN₂

SMILES

CNC(=NC)CC1=CC=C(C=C1)Cl

InChI

InChI=1S/C10H13ClN2/c1-12-10(13-2)7-8-3-5-9(11)6-4-8/h3-6H,7H2,1-2H3,(H,12,13)

InChIKey

ZVMXFJARTBNQOY-UHFFFAOYSA-N

Compound name

2-(4-chlorophenyl)-N,N'-dimethylethanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 3
Patents: 196.07672 Da
Monoisotopic Mass: 1.9
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]+	197.08400	143.1
[M+Na]+	219.06594	150.7
[M-H]-	195.06944	148.0
[M+NH4]+	214.11054	163.7
[M+K]+	235.03988	147.2
[M+H-H2O]+	179.07398	137.5
[M+HCOO]-	241.07492	165.5
[M+CH3COO]-	255.09057	190.2
[M+Na-2H]-	217.05139	149.3
[M]+	196.07617	144.7
[M]-	196.07727	144.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe