CID 695062

304896-35-3

Structural Information

Molecular Formula
C14H8Cl2N2O2
SMILES
C1=CC(=C(C(=C1)Cl)Cl)C2=CC=C(O2)/C=C(\C#N)/C(=O)N
InChI
InChI=1S/C14H8Cl2N2O2/c15-11-3-1-2-10(13(11)16)12-5-4-9(20-12)6-8(7-17)14(18)19/h1-6H,(H2,18,19)/b8-6+
InChIKey
ULJYZLXJKSLSRQ-SOFGYWHQSA-N
Compound name
(E)-2-cyano-3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.99628 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.00356 165.1
[M+Na]+ 328.98550 177.6
[M+NH4]+ 324.03010 169.2
[M+K]+ 344.95944 169.6
[M-H]- 304.98900 161.9
[M+Na-2H]- 326.97095 168.2
[M]+ 305.99573 165.6
[M]- 305.99683 165.6
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.