CID 285483

4-ethenylbenzamide

Structural Information

Molecular Formula
C9H9NO
SMILES
C=CC1=CC=C(C=C1)C(=O)N
InChI
InChI=1S/C9H9NO/c1-2-7-3-5-8(6-4-7)9(10)11/h2-6H,1H2,(H2,10,11)
InChIKey
YFCIQZMEGLCRKA-UHFFFAOYSA-N
Compound name
4-ethenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

225
Patents

147.06842 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.07570 130.3
[M+Na]+ 170.05764 142.3
[M+NH4]+ 165.10224 138.6
[M+K]+ 186.03158 136.2
[M-H]- 146.06114 132.6
[M+Na-2H]- 168.04309 137.0
[M]+ 147.06787 132.5
[M]- 147.06897 132.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe