CID 156915

78675-82-8

Structural Information

Molecular Formula
C17H18Cl2N2O
SMILES
CC(C)(C)C(=O)N(CC1=CN=CC=C1)C2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C17H18Cl2N2O/c1-17(2,3)16(22)21(11-12-5-4-8-20-10-12)15-7-6-13(18)9-14(15)19/h4-10H,11H2,1-3H3
InChIKey
NOLPQGVVZVMABW-UHFFFAOYSA-N
Compound name
N-(2,4-dichlorophenyl)-2,2-dimethyl-N-(pyridin-3-ylmethyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

336.07962 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.08690 178.2
[M+Na]+ 359.06884 193.2
[M+NH4]+ 354.11344 186.4
[M+K]+ 375.04278 185.0
[M-H]- 335.07234 182.3
[M+Na-2H]- 357.05429 187.0
[M]+ 336.07907 182.3
[M]- 336.08017 182.3
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