CID 7033183

302822-69-1

Structural Information

Molecular Formula
C19H19ClN2O3
SMILES
COCCNC(=O)/C(=C/C1=CC=C(C=C1)Cl)/NC(=O)C2=CC=CC=C2
InChI
InChI=1S/C19H19ClN2O3/c1-25-12-11-21-19(24)17(13-14-7-9-16(20)10-8-14)22-18(23)15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3,(H,21,24)(H,22,23)/b17-13-
InChIKey
GVHHULMZSVPVOJ-LGMDPLHJSA-N
Compound name
N-[(Z)-1-(4-chlorophenyl)-3-(2-methoxyethylamino)-3-oxoprop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.10843 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.11571 184.6
[M+Na]+ 381.09765 195.8
[M+NH4]+ 376.14225 190.7
[M+K]+ 397.07159 188.7
[M-H]- 357.10115 188.1
[M+Na-2H]- 379.08310 191.4
[M]+ 358.10788 187.2
[M]- 358.10898 187.2
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

No patent data available for this compound.