CID 883212

C.i. direct yellow 24

Structural Information

Molecular Formula
C17H16N2O3
SMILES
COC1=CC=C(C=C1)/C=C/C(=O)NC2=CC=C(C=C2)C(=O)N
InChI
InChI=1S/C17H16N2O3/c1-22-15-9-2-12(3-10-15)4-11-16(20)19-14-7-5-13(6-8-14)17(18)21/h2-11H,1H3,(H2,18,21)(H,19,20)/b11-4+
InChIKey
ADUAASDQTXSPNT-NYYWCZLTSA-N
Compound name
4-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

123
Patents

296.1161 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.123376 169.0
[M+Na]+ 319.105318 174.6
[M-H]- 295.108824 175.1
[M+NH4]+ 314.149923 183.0
[M+K]+ 335.079258 170.7
[M+H-H2O]+ 279.113360 160.5
[M+HCOO]- 341.114301 193.0
[M+CH3COO]- 355.129951 207.0
[M+Na-2H]- 317.090766 171.3
[M]+ 296.11555142 168.2
[M]- 296.11664858 168.2
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

patents stripe