CID 2232798

297145-47-2

Structural Information

Molecular Formula
C20H22N2O4
SMILES
COCCNC(=O)/C(=C/C1=CC=C(C=C1)OC)/NC(=O)C2=CC=CC=C2
InChI
InChI=1S/C20H22N2O4/c1-25-13-12-21-20(24)18(14-15-8-10-17(26-2)11-9-15)22-19(23)16-6-4-3-5-7-16/h3-11,14H,12-13H2,1-2H3,(H,21,24)(H,22,23)/b18-14-
InChIKey
VAGCJPGMJPXOQM-JXAWBTAJSA-N
Compound name
N-[(Z)-3-(2-methoxyethylamino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.15796 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.16524 185.3
[M+Na]+ 377.14718 188.1
[M-H]- 353.15068 191.0
[M+NH4]+ 372.19178 196.6
[M+K]+ 393.12112 185.2
[M+H-H2O]+ 337.15522 175.8
[M+HCOO]- 399.15616 208.0
[M+CH3COO]- 413.17181 217.7
[M+Na-2H]- 375.13263 186.7
[M]+ 354.15741 186.8
[M]- 354.15851 186.8
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

No patent data available for this compound.