CID 45038

3-amino-2,5-dichloro-n-cyclopropylbenzamide

Structural Information

Molecular Formula
C10H10Cl2N2O
SMILES
C1CC1NC(=O)C2=C(C(=CC(=C2)Cl)N)Cl
InChI
InChI=1S/C10H10Cl2N2O/c11-5-3-7(9(12)8(13)4-5)10(15)14-6-1-2-6/h3-4,6H,1-2,13H2,(H,14,15)
InChIKey
OWCLEIBTBKZMOF-UHFFFAOYSA-N
Compound name
3-amino-2,5-dichloro-N-cyclopropylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.01701 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.024286 143.6
[M+Na]+ 267.006228 154.1
[M-H]- 243.009734 150.1
[M+NH4]+ 262.050833 157.2
[M+K]+ 282.980168 147.6
[M+H-H2O]+ 227.014270 139.0
[M+HCOO]- 289.015211 159.8
[M+CH3COO]- 303.030861 197.8
[M+Na-2H]- 264.991676 147.1
[M]+ 244.01646142 146.9
[M]- 244.01755858 146.9
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.