CID 71587864

Eclatnoid pm 126

Structural Information

Molecular Formula
C17H18N2O5
SMILES
COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)CC(=O)NO)OC
InChI
InChI=1S/C17H18N2O5/c1-23-14-8-5-12(10-15(14)24-2)17(21)18-13-6-3-11(4-7-13)9-16(20)19-22/h3-8,10,22H,9H2,1-2H3,(H,18,21)(H,19,20)
InChIKey
KHNAOPLSQBKBGG-UHFFFAOYSA-N
Compound name
N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-3,4-dimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

330.12158 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.128856 174.9
[M+Na]+ 353.110798 180.2
[M-H]- 329.114304 180.5
[M+NH4]+ 348.155403 187.2
[M+K]+ 369.084738 178.0
[M+H-H2O]+ 313.118840 166.2
[M+HCOO]- 375.119781 198.1
[M+CH3COO]- 389.135431 211.8
[M+Na-2H]- 351.096246 177.4
[M]+ 330.12103142 177.2
[M]- 330.12212858 177.2
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