CID 126500457

957476-07-2

Structural Information

Molecular Formula
C20H24N2O8
SMILES
COC1=CC(=C(C(=C1)OC)NC(=O)C(=O)NC2=C(C=C(C=C2OC)OC)OC)OC
InChI
InChI=1S/C20H24N2O8/c1-25-11-7-13(27-3)17(14(8-11)28-4)21-19(23)20(24)22-18-15(29-5)9-12(26-2)10-16(18)30-6/h7-10H,1-6H3,(H,21,23)(H,22,24)
InChIKey
NGVJMONAWAGMOA-UHFFFAOYSA-N
Compound name
N,N'-bis(2,4,6-trimethoxyphenyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

81
Patents

420.15326 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.160536 195.2
[M+Na]+ 443.142478 201.4
[M-H]- 419.145984 202.6
[M+NH4]+ 438.187083 205.0
[M+K]+ 459.116418 202.3
[M+H-H2O]+ 403.150520 185.4
[M+HCOO]- 465.151461 219.2
[M+CH3COO]- 479.167111 233.2
[M+Na-2H]- 441.127926 195.1
[M]+ 420.15271142 205.7
[M]- 420.15380858 205.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe