CID 587201

285158-15-8

Structural Information

Molecular Formula
C15H10BrCl2NO2
SMILES
C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)CCl)Cl
InChI
InChI=1S/C15H10BrCl2NO2/c16-9-5-6-13(19-14(20)8-17)11(7-9)15(21)10-3-1-2-4-12(10)18/h1-7H,8H2,(H,19,20)
InChIKey
BXAWZJZMYSSHAK-UHFFFAOYSA-N
Compound name
N-[4-bromo-2-(2-chlorobenzoyl)phenyl]-2-chloroacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.9272 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.93448 172.2
[M+Na]+ 407.91642 184.4
[M-H]- 383.91992 180.9
[M+NH4]+ 402.96102 188.9
[M+K]+ 423.89036 169.6
[M+H-H2O]+ 367.92446 172.2
[M+HCOO]- 429.92540 184.3
[M+CH3COO]- 443.94105 213.1
[M+Na-2H]- 405.90187 175.6
[M]+ 384.92665 194.0
[M]- 384.92775 194.0
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

patents stripe