CID 6876540

P-toluic (4-chlorobenzylidene)hydrazide

Structural Information

Molecular Formula
C15H13ClN2O
SMILES
CC1=CC=C(C=C1)C(=O)N/N=C/C2=CC=C(C=C2)Cl
InChI
InChI=1S/C15H13ClN2O/c1-11-2-6-13(7-3-11)15(19)18-17-10-12-4-8-14(16)9-5-12/h2-10H,1H3,(H,18,19)/b17-10+
InChIKey
NRWQQRUMXPWHTJ-LICLKQGHSA-N
Compound name
N-[(E)-(4-chlorophenyl)methylideneamino]-4-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

272.07166 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.07894 161.5
[M+Na]+ 295.06088 169.5
[M-H]- 271.06438 169.6
[M+NH4]+ 290.10548 178.7
[M+K]+ 311.03482 164.1
[M+H-H2O]+ 255.06892 154.2
[M+HCOO]- 317.06986 184.2
[M+CH3COO]- 331.08551 203.3
[M+Na-2H]- 293.04633 166.9
[M]+ 272.07111 163.7
[M]- 272.07221 163.7
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.