CID 6481533

2-amino-5-chloro-n-(4-isopropylphenyl)benzamide

Structural Information

Molecular Formula
C16H17ClN2O
SMILES
CC(C)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)Cl)N
InChI
InChI=1S/C16H17ClN2O/c1-10(2)11-3-6-13(7-4-11)19-16(20)14-9-12(17)5-8-15(14)18/h3-10H,18H2,1-2H3,(H,19,20)
InChIKey
SGBUQTVIOLYMTF-UHFFFAOYSA-N
Compound name
2-amino-5-chloro-N-(4-propan-2-ylphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.10294 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.11022 167.5
[M+Na]+ 311.09216 174.9
[M-H]- 287.09566 174.0
[M+NH4]+ 306.13676 183.4
[M+K]+ 327.06610 169.4
[M+H-H2O]+ 271.10020 160.7
[M+HCOO]- 333.10114 186.6
[M+CH3COO]- 347.11679 206.8
[M+Na-2H]- 309.07761 169.0
[M]+ 288.10239 167.9
[M]- 288.10349 167.9
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.