CID 2428990

2-chloro-n-(3-formylphenyl)benzamide

Structural Information

Molecular Formula
C14H10ClNO2
SMILES
C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C=O)Cl
InChI
InChI=1S/C14H10ClNO2/c15-13-7-2-1-6-12(13)14(18)16-11-5-3-4-10(8-11)9-17/h1-9H,(H,16,18)
InChIKey
GAKQNQAYVNFMJN-UHFFFAOYSA-N
Compound name
2-chloro-N-(3-formylphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

259.04 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.04728 155.0
[M+Na]+ 282.02922 163.8
[M-H]- 258.03272 162.0
[M+NH4]+ 277.07382 172.3
[M+K]+ 298.00316 158.4
[M+H-H2O]+ 242.03726 148.4
[M+HCOO]- 304.03820 175.7
[M+CH3COO]- 318.05385 195.5
[M+Na-2H]- 280.01467 160.3
[M]+ 259.03945 157.2
[M]- 259.04055 157.2
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

patents stripe