CID 3049625

65051-19-6

Structural Information

Molecular Formula
C12H16N2O6
SMILES
COC1=CC(=CC(=C1OC)OC)NC(=O)CC(=O)NO
InChI
InChI=1S/C12H16N2O6/c1-18-8-4-7(5-9(19-2)12(8)20-3)13-10(15)6-11(16)14-17/h4-5,17H,6H2,1-3H3,(H,13,15)(H,14,16)
InChIKey
ZMFPNNHOAMMEKY-UHFFFAOYSA-N
Compound name
N'-hydroxy-N-(3,4,5-trimethoxyphenyl)propanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

284.10083 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.108106 160.4
[M+Na]+ 307.090048 166.5
[M-H]- 283.093554 163.0
[M+NH4]+ 302.134653 175.0
[M+K]+ 323.063988 166.5
[M+H-H2O]+ 267.098090 153.1
[M+HCOO]- 329.099031 184.1
[M+CH3COO]- 343.114681 203.2
[M+Na-2H]- 305.075496 162.8
[M]+ 284.10028142 164.8
[M]- 284.10137858 164.8
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

patents stripe