CID 258824

Nsc88167

Structural Information

Molecular Formula
C18H12Cl2N2O2
SMILES
C1=CC=C2C(=C1)C=CC=C2C(=O)NNC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI
InChI=1S/C18H12Cl2N2O2/c19-15-9-8-12(10-16(15)20)17(23)21-22-18(24)14-7-3-5-11-4-1-2-6-13(11)14/h1-10H,(H,21,23)(H,22,24)
InChIKey
COKBNZWCZJDMSP-UHFFFAOYSA-N
Compound name
N'-(3,4-dichlorobenzoyl)naphthalene-1-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

358.0276 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.03488 178.7
[M+Na]+ 381.01682 187.3
[M-H]- 357.02032 185.7
[M+NH4]+ 376.06142 193.3
[M+K]+ 396.99076 180.3
[M+H-H2O]+ 341.02486 172.2
[M+HCOO]- 403.02580 192.9
[M+CH3COO]- 417.04145 189.3
[M+Na-2H]- 379.00227 183.0
[M]+ 358.02705 182.0
[M]- 358.02815 182.0
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

No patent data available for this compound.