CID 58274

N'-(alpha-(4-chlorophenyl)benzyl)-n,n-dimethylformamidine

Structural Information

Molecular Formula
C16H17ClN2
SMILES
CN(C)C=NC(C1=CC=CC=C1)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C16H17ClN2/c1-19(2)12-18-16(13-6-4-3-5-7-13)14-8-10-15(17)11-9-14/h3-12,16H,1-2H3
InChIKey
GCOVWSRXZCWSIR-UHFFFAOYSA-N
Compound name
N'-[(4-chlorophenyl)-phenylmethyl]-N,N-dimethylmethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

272.10803 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.11531 164.0
[M+Na]+ 295.09725 170.4
[M-H]- 271.10075 172.8
[M+NH4]+ 290.14185 181.5
[M+K]+ 311.07119 166.1
[M+H-H2O]+ 255.10529 156.0
[M+HCOO]- 317.10623 186.3
[M+CH3COO]- 331.12188 208.0
[M+Na-2H]- 293.08270 168.8
[M]+ 272.10748 166.8
[M]- 272.10858 166.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe