CID 121206

Benzanilide, 5-chloro-2-(methylamino)-

Structural Information

Molecular Formula
C14H13ClN2O
SMILES
CNC1=C(C=C(C=C1)Cl)C(=O)NC2=CC=CC=C2
InChI
InChI=1S/C14H13ClN2O/c1-16-13-8-7-10(15)9-12(13)14(18)17-11-5-3-2-4-6-11/h2-9,16H,1H3,(H,17,18)
InChIKey
XHFLVBLUVBWYQA-UHFFFAOYSA-N
Compound name
5-chloro-2-(methylamino)-N-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.07166 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.07894 157.6
[M+Na]+ 283.06088 165.2
[M-H]- 259.06438 164.4
[M+NH4]+ 278.10548 174.6
[M+K]+ 299.03482 159.8
[M+H-H2O]+ 243.06892 150.7
[M+HCOO]- 305.06986 178.9
[M+CH3COO]- 319.08551 199.3
[M+Na-2H]- 281.04633 163.1
[M]+ 260.07111 158.4
[M]- 260.07221 158.4
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.