CID 24843876

2,4-dichloro-alpha-dimethylaminopropiophenone hydrochloride

Structural Information

Molecular Formula
C11H13Cl2NO
SMILES
CC(C(=O)C1=C(C=C(C=C1)Cl)Cl)N(C)C
InChI
InChI=1S/C11H13Cl2NO/c1-7(14(2)3)11(15)9-5-4-8(12)6-10(9)13/h4-7H,1-3H3
InChIKey
QNWFGVRKYANXKC-UHFFFAOYSA-N
Compound name
1-(2,4-dichlorophenyl)-2-(dimethylamino)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.03741 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.04469 149.9
[M+Na]+ 268.02663 158.6
[M-H]- 244.03013 154.6
[M+NH4]+ 263.07123 169.3
[M+K]+ 284.00057 154.8
[M+H-H2O]+ 228.03467 145.7
[M+HCOO]- 290.03561 164.3
[M+CH3COO]- 304.05126 199.1
[M+Na-2H]- 266.01208 151.7
[M]+ 245.03686 154.6
[M]- 245.03796 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.