CID 4613398

2-propenoic acid, 3-(2-chlorophenyl)-2-methyl-

Structural Information

Molecular Formula
C10H9ClO2
SMILES
CC(=CC1=CC=CC=C1Cl)C(=O)O
InChI
InChI=1S/C10H9ClO2/c1-7(10(12)13)6-8-4-2-3-5-9(8)11/h2-6H,1H3,(H,12,13)
InChIKey
OYWFDXZJJUELMZ-UHFFFAOYSA-N
Compound name
3-(2-chlorophenyl)-2-methylprop-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

196.02911 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.03639 139.2
[M+Na]+ 219.01833 152.2
[M+NH4]+ 214.06293 147.3
[M+K]+ 234.99227 146.0
[M-H]- 195.02183 140.3
[M+Na-2H]- 217.00378 145.2
[M]+ 196.02856 141.5
[M]- 196.02966 141.5
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

patents stripe