CID 3020552

85223-04-7

Structural Information

Molecular Formula
C18H18N4O3
SMILES
CC(=O)NC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N3CCCC3=O)O
InChI
InChI=1S/C18H18N4O3/c1-12(23)19-13-4-6-14(7-5-13)20-21-16-9-8-15(11-17(16)24)22-10-2-3-18(22)25/h4-9,11,24H,2-3,10H2,1H3,(H,19,23)
InChIKey
NAMNMCZAYCXRSK-UHFFFAOYSA-N
Compound name
N-[4-[[2-hydroxy-4-(2-oxopyrrolidin-1-yl)phenyl]diazenyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.13788 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.145156 177.0
[M+Na]+ 361.127098 182.6
[M-H]- 337.130604 187.1
[M+NH4]+ 356.171703 190.3
[M+K]+ 377.101038 179.1
[M+H-H2O]+ 321.135140 167.0
[M+HCOO]- 383.136081 202.7
[M+CH3COO]- 397.151731 219.0
[M+Na-2H]- 359.112546 179.1
[M]+ 338.13733142 176.1
[M]- 338.13842858 176.1
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.