CID 15956141

Methyl (z)-2-(3,4-dichlorophenyl)-3-methoxy-prop-2-enoate

Structural Information

Molecular Formula
C11H10Cl2O3
SMILES
CO/C=C(/C1=CC(=C(C=C1)Cl)Cl)\C(=O)OC
InChI
InChI=1S/C11H10Cl2O3/c1-15-6-8(11(14)16-2)7-3-4-9(12)10(13)5-7/h3-6H,1-2H3/b8-6-
InChIKey
SGIKRDSQOGGLLT-VURMDHGXSA-N
Compound name
methyl (Z)-2-(3,4-dichlorophenyl)-3-methoxyprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.0007 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.00798 149.4
[M+Na]+ 282.98992 159.2
[M-H]- 258.99342 153.0
[M+NH4]+ 278.03452 168.0
[M+K]+ 298.96386 154.7
[M+H-H2O]+ 242.99796 145.6
[M+HCOO]- 304.99890 163.0
[M+CH3COO]- 319.01455 192.7
[M+Na-2H]- 280.97537 151.9
[M]+ 260.00015 155.6
[M]- 260.00125 155.6
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.