CID 9557687

2clphcon2 3meop

Structural Information

Molecular Formula
C15H13ClN2O2
SMILES
COC1=CC=CC(=C1)/C=N/NC(=O)C2=CC=CC=C2Cl
InChI
InChI=1S/C15H13ClN2O2/c1-20-12-6-4-5-11(9-12)10-17-18-15(19)13-7-2-3-8-14(13)16/h2-10H,1H3,(H,18,19)/b17-10+
InChIKey
IBYCSGWRECRHHC-LICLKQGHSA-N
Compound name
2-chloro-N-[(E)-(3-methoxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.06656 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.07384 164.3
[M+Na]+ 311.05578 172.2
[M-H]- 287.05928 172.4
[M+NH4]+ 306.10038 180.8
[M+K]+ 327.02972 167.5
[M+H-H2O]+ 271.06382 156.8
[M+HCOO]- 333.06476 187.2
[M+CH3COO]- 347.08041 205.4
[M+Na-2H]- 309.04123 169.8
[M]+ 288.06601 168.0
[M]- 288.06711 168.0
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.