CID 209005

2-(p-chlorobenzamido)-1-chloro-3-phenylpropane

Structural Information

Molecular Formula
C16H15Cl2NO
SMILES
C1=CC=C(C=C1)CC(CCl)NC(=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C16H15Cl2NO/c17-11-15(10-12-4-2-1-3-5-12)19-16(20)13-6-8-14(18)9-7-13/h1-9,15H,10-11H2,(H,19,20)
InChIKey
KXAVHZVNXIENGY-UHFFFAOYSA-N
Compound name
4-chloro-N-(1-chloro-3-phenylpropan-2-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.05307 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.06035 168.3
[M+Na]+ 330.04229 175.1
[M-H]- 306.04579 173.7
[M+NH4]+ 325.08689 183.8
[M+K]+ 346.01623 168.3
[M+H-H2O]+ 290.05033 161.9
[M+HCOO]- 352.05127 181.8
[M+CH3COO]- 366.06692 204.3
[M+Na-2H]- 328.02774 171.2
[M]+ 307.05252 170.8
[M]- 307.05362 170.8
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.