CID 1051985

N-[4-(2-chloroacetamido)-2,5-diethoxyphenyl]benzamide

Structural Information

Molecular Formula
C19H21ClN2O4
SMILES
CCOC1=CC(=C(C=C1NC(=O)CCl)OCC)NC(=O)C2=CC=CC=C2
InChI
InChI=1S/C19H21ClN2O4/c1-3-25-16-11-15(22-19(24)13-8-6-5-7-9-13)17(26-4-2)10-14(16)21-18(23)12-20/h5-11H,3-4,12H2,1-2H3,(H,21,23)(H,22,24)
InChIKey
XJWNMUZWBARGKZ-UHFFFAOYSA-N
Compound name
N-[4-[(2-chloroacetyl)amino]-2,5-diethoxyphenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

376.119 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.12628 187.7
[M+Na]+ 399.10822 193.6
[M-H]- 375.11172 194.2
[M+NH4]+ 394.15282 199.9
[M+K]+ 415.08216 189.3
[M+H-H2O]+ 359.11626 179.6
[M+HCOO]- 421.11720 207.2
[M+CH3COO]- 435.13285 221.3
[M+Na-2H]- 397.09367 189.0
[M]+ 376.11845 193.6
[M]- 376.11955 193.6
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.