CID 9574476

1-naphthalenecarboxaldehyde, 4-methoxy-, (5,7-dichloro-2-methyl-4-quinolinyl)hydrazone

Structural Information

Molecular Formula
C22H17Cl2N3O
SMILES
CC1=CC(=C2C(=CC(=CC2=N1)Cl)Cl)N/N=C/C3=CC=C(C4=CC=CC=C34)OC
InChI
InChI=1S/C22H17Cl2N3O/c1-13-9-20(22-18(24)10-15(23)11-19(22)26-13)27-25-12-14-7-8-21(28-2)17-6-4-3-5-16(14)17/h3-12H,1-2H3,(H,26,27)/b25-12+
InChIKey
PCWICMDRCCQWSI-BRJLIKDPSA-N
Compound name
5,7-dichloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]-2-methylquinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

409.07486 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 410.08214 196.4
[M+Na]+ 432.06408 208.6
[M-H]- 408.06758 204.4
[M+NH4]+ 427.10868 209.7
[M+K]+ 448.03802 200.0
[M+H-H2O]+ 392.07212 186.8
[M+HCOO]- 454.07306 211.3
[M+CH3COO]- 468.08871 207.0
[M+Na-2H]- 430.04953 202.6
[M]+ 409.07431 204.7
[M]- 409.07541 204.7
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.