CID 23027

6525-27-5

Structural Information

Molecular Formula
C15H18N2O3
SMILES
CC(=O)NC1=CC(=C(C=C1)OCC=C)C(=O)NCC=C
InChI
InChI=1S/C15H18N2O3/c1-4-8-16-15(19)13-10-12(17-11(3)18)6-7-14(13)20-9-5-2/h4-7,10H,1-2,8-9H2,3H3,(H,16,19)(H,17,18)
InChIKey
DTTDWEHZOXBELV-UHFFFAOYSA-N
Compound name
5-acetamido-2-prop-2-enoxy-N-prop-2-enylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.13174 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.13902 164.1
[M+Na]+ 297.12096 169.7
[M-H]- 273.12446 167.5
[M+NH4]+ 292.16556 179.7
[M+K]+ 313.09490 166.5
[M+H-H2O]+ 257.12900 156.8
[M+HCOO]- 319.12994 188.2
[M+CH3COO]- 333.14559 204.9
[M+Na-2H]- 295.10641 165.9
[M]+ 274.13119 165.5
[M]- 274.13229 165.5
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

No patent data available for this compound.