CID 135845650

881467-88-5

Structural Information

Molecular Formula
C19H18N4O2
SMILES
CCC1=CC=C(C=C1)NC(=O)C(=O)N/N=C/C2=CNC3=CC=CC=C32
InChI
InChI=1S/C19H18N4O2/c1-2-13-7-9-15(10-8-13)22-18(24)19(25)23-21-12-14-11-20-17-6-4-3-5-16(14)17/h3-12,20H,2H2,1H3,(H,22,24)(H,23,25)/b21-12+
InChIKey
NZXMECMPSVMTGG-CIAFOILYSA-N
Compound name
N-(4-ethylphenyl)-N'-[(E)-1H-indol-3-ylmethylideneamino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.14297 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.15025 177.3
[M+Na]+ 357.13219 183.4
[M-H]- 333.13569 184.0
[M+NH4]+ 352.17679 191.3
[M+K]+ 373.10613 178.2
[M+H-H2O]+ 317.14023 168.0
[M+HCOO]- 379.14117 202.8
[M+CH3COO]- 393.15682 215.3
[M+Na-2H]- 355.11764 182.3
[M]+ 334.14242 177.5
[M]- 334.14352 177.5
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.