CID 532053

Acetamide, n-(1-naphthyl)-2,2,2-trichloro-

Structural Information

Molecular Formula
C12H8Cl3NO
SMILES
C1=CC=C2C(=C1)C=CC=C2NC(=O)C(Cl)(Cl)Cl
InChI
InChI=1S/C12H8Cl3NO/c13-12(14,15)11(17)16-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H,16,17)
InChIKey
FEXNJZJFISBCHC-UHFFFAOYSA-N
Compound name
2,2,2-trichloro-N-naphthalen-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.96713 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.97441 160.0
[M+Na]+ 309.95635 174.8
[M+NH4]+ 305.00095 169.4
[M+K]+ 325.93029 166.2
[M-H]- 285.95985 162.6
[M+Na-2H]- 307.94180 167.5
[M]+ 286.96658 163.9
[M]- 286.96768 163.9
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.