CID 14594

1212-25-5

Structural Information

Molecular Formula
C10H10Cl2FNO2
SMILES
C1=CC(=CC=C1CC(=O)NC(C(Cl)Cl)O)F
InChI
InChI=1S/C10H10Cl2FNO2/c11-9(12)10(16)14-8(15)5-6-1-3-7(13)4-2-6/h1-4,9-10,16H,5H2,(H,14,15)
InChIKey
LNMOMAPHKHLJLB-UHFFFAOYSA-N
Compound name
N-(2,2-dichloro-1-hydroxyethyl)-2-(4-fluorophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.00726 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.01454 150.8
[M+Na]+ 287.99648 158.2
[M-H]- 263.99998 151.2
[M+NH4]+ 283.04108 167.7
[M+K]+ 303.97042 153.1
[M+H-H2O]+ 248.00452 146.1
[M+HCOO]- 310.00546 161.9
[M+CH3COO]- 324.02111 193.9
[M+Na-2H]- 285.98193 152.4
[M]+ 265.00671 151.4
[M]- 265.00781 151.4
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.