CID 135533825

444938-92-5

Structural Information

Molecular Formula
C17H17N3O4
SMILES
CC1=CC=CC=C1NC(=O)C(=O)N/N=C/C2=C(C=CC(=C2)OC)O
InChI
InChI=1S/C17H17N3O4/c1-11-5-3-4-6-14(11)19-16(22)17(23)20-18-10-12-9-13(24-2)7-8-15(12)21/h3-10,21H,1-2H3,(H,19,22)(H,20,23)/b18-10+
InChIKey
VNWBOWUUZXLONW-VCHYOVAHSA-N
Compound name
N'-[(E)-(2-hydroxy-5-methoxyphenyl)methylideneamino]-N-(2-methylphenyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.12192 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.129196 175.3
[M+Na]+ 350.111138 180.8
[M-H]- 326.114644 182.3
[M+NH4]+ 345.155743 188.2
[M+K]+ 366.085078 178.2
[M+H-H2O]+ 310.119180 166.3
[M+HCOO]- 372.120121 201.1
[M+CH3COO]- 386.135771 215.2
[M+Na-2H]- 348.096586 178.5
[M]+ 327.12137142 176.5
[M]- 327.12246858 176.5
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.