CID 15111018

4-chloro-2-ethenylbenzamide

Structural Information

Molecular Formula
C9H8ClNO
SMILES
C=CC1=C(C=CC(=C1)Cl)C(=O)N
InChI
InChI=1S/C9H8ClNO/c1-2-6-5-7(10)3-4-8(6)9(11)12/h2-5H,1H2,(H2,11,12)
InChIKey
CDALGLDUDJSSLC-UHFFFAOYSA-N
Compound name
4-chloro-2-ethenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.02943 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.03671 135.3
[M+Na]+ 204.01865 148.6
[M+NH4]+ 199.06325 143.9
[M+K]+ 219.99259 141.8
[M-H]- 180.02215 137.7
[M+Na-2H]- 202.00410 142.0
[M]+ 181.02888 138.1
[M]- 181.02998 138.1
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.