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

15
Patents

284.10083 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.10811 160.4
[M+Na]+ 307.09005 166.5
[M-H]- 283.09355 163.0
[M+NH4]+ 302.13465 175.0
[M+K]+ 323.06399 166.5
[M+H-H2O]+ 267.09809 153.1
[M+HCOO]- 329.09903 184.1
[M+CH3COO]- 343.11468 203.2
[M+Na-2H]- 305.07550 162.8
[M]+ 284.10028 164.8
[M]- 284.10138 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