CID 9639031

N-(1-naphthyl)-2-oxo-2-(2-(2-(trifluoromethyl)benzylidene)hydrazino)acetamide

Structural Information

Molecular Formula
C20H14F3N3O2
SMILES
C1=CC=C2C(=C1)C=CC=C2NC(=O)C(=O)N/N=C/C3=CC=CC=C3C(F)(F)F
InChI
InChI=1S/C20H14F3N3O2/c21-20(22,23)16-10-4-2-7-14(16)12-24-26-19(28)18(27)25-17-11-5-8-13-6-1-3-9-15(13)17/h1-12H,(H,25,27)(H,26,28)/b24-12+
InChIKey
JDVUQNVSROIZDF-WYMPLXKRSA-N
Compound name
N-naphthalen-1-yl-N'-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

385.10382 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.11110 186.3
[M+Na]+ 408.09304 192.3
[M-H]- 384.09654 190.9
[M+NH4]+ 403.13764 198.1
[M+K]+ 424.06698 187.1
[M+H-H2O]+ 368.10108 174.5
[M+HCOO]- 430.10202 207.0
[M+CH3COO]- 444.11767 226.1
[M+Na-2H]- 406.07849 191.5
[M]+ 385.10327 182.1
[M]- 385.10437 182.1
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.