CID 56198

Brn 2841926

Structural Information

Molecular Formula
C11H15ClN2O
SMILES
CN(C)C(=O)CN(C)C1=CC=C(C=C1)Cl
InChI
InChI=1S/C11H15ClN2O/c1-13(2)11(15)8-14(3)10-6-4-9(12)5-7-10/h4-7H,8H2,1-3H3
InChIKey
QMWPWHWIAZOESW-UHFFFAOYSA-N
Compound name
2-(4-chloro-N-methylanilino)-N,N-dimethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.0873 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.09458 150.4
[M+Na]+ 249.07652 157.4
[M-H]- 225.08002 156.7
[M+NH4]+ 244.12112 170.3
[M+K]+ 265.05046 156.0
[M+H-H2O]+ 209.08456 144.3
[M+HCOO]- 271.08550 172.3
[M+CH3COO]- 285.10115 200.3
[M+Na-2H]- 247.06197 154.1
[M]+ 226.08675 154.6
[M]- 226.08785 154.6
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.