CID 134114503

2,4,6-trichloro-n-methoxy-n-methylbenzamide

Structural Information

Molecular Formula
C9H8Cl3NO2
SMILES
CN(C(=O)C1=C(C=C(C=C1Cl)Cl)Cl)OC
InChI
InChI=1S/C9H8Cl3NO2/c1-13(15-2)9(14)8-6(11)3-5(10)4-7(8)12/h3-4H,1-2H3
InChIKey
AIZZXQFVDXAIEJ-UHFFFAOYSA-N
Compound name
2,4,6-trichloro-N-methoxy-N-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.96207 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.96935 149.5
[M+Na]+ 289.95129 160.0
[M-H]- 265.95479 153.5
[M+NH4]+ 284.99589 168.3
[M+K]+ 305.92523 156.0
[M+H-H2O]+ 249.95933 146.4
[M+HCOO]- 311.96027 160.2
[M+CH3COO]- 325.97592 200.0
[M+Na-2H]- 287.93674 151.8
[M]+ 266.96152 155.8
[M]- 266.96262 155.8
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.