CID 673331

N-(1,3-benzodioxol-5-yl)-2-(2,4-dichlorophenoxy)acetamide

Structural Information

Molecular Formula
C15H11Cl2NO4
SMILES
C1OC2=C(O1)C=C(C=C2)NC(=O)COC3=C(C=C(C=C3)Cl)Cl
InChI
InChI=1S/C15H11Cl2NO4/c16-9-1-3-12(11(17)5-9)20-7-15(19)18-10-2-4-13-14(6-10)22-8-21-13/h1-6H,7-8H2,(H,18,19)
InChIKey
QMIIKEUJIHCYKV-UHFFFAOYSA-N
Compound name
N-(1,3-benzodioxol-5-yl)-2-(2,4-dichlorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.0065 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.01378 174.7
[M+Na]+ 361.99572 184.1
[M-H]- 337.99922 183.2
[M+NH4]+ 357.04032 189.5
[M+K]+ 377.96966 180.8
[M+H-H2O]+ 322.00376 169.1
[M+HCOO]- 384.00470 187.1
[M+CH3COO]- 398.02035 186.5
[M+Na-2H]- 359.98117 178.8
[M]+ 339.00595 181.9
[M]- 339.00705 181.9
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.