CID 9575543

Benzenecarboximidamide, 3-chloro-n'-[(1-naphthalenylcarbonyl)oxy]-

Structural Information

Molecular Formula
C18H13ClN2O2
SMILES
C1=CC=C2C(=C1)C=CC=C2C(=O)O/N=C(\C3=CC(=CC=C3)Cl)/N
InChI
InChI=1S/C18H13ClN2O2/c19-14-8-3-7-13(11-14)17(20)21-23-18(22)16-10-4-6-12-5-1-2-9-15(12)16/h1-11H,(H2,20,21)
InChIKey
GDHAUAHPPSWSNX-UHFFFAOYSA-N
Compound name
[(E)-[amino-(3-chlorophenyl)methylidene]amino] naphthalene-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

324.06656 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.07384 173.2
[M+Na]+ 347.05578 180.8
[M-H]- 323.05928 181.4
[M+NH4]+ 342.10038 188.6
[M+K]+ 363.02972 175.2
[M+H-H2O]+ 307.06382 165.3
[M+HCOO]- 369.06476 193.2
[M+CH3COO]- 383.08041 212.4
[M+Na-2H]- 345.04123 178.3
[M]+ 324.06601 175.2
[M]- 324.06711 175.2
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.