CID 213579

Fc 159

Structural Information

Molecular Formula
C14H19NO3
SMILES
CCCNC(=O)C1=C(C(=CC(=C1)CC=C)OC)O
InChI
InChI=1S/C14H19NO3/c1-4-6-10-8-11(14(17)15-7-5-2)13(16)12(9-10)18-3/h4,8-9,16H,1,5-7H2,2-3H3,(H,15,17)
InChIKey
GPJGOSIBSZEPAJ-UHFFFAOYSA-N
Compound name
2-hydroxy-3-methoxy-5-prop-2-enyl-N-propylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.13649 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.14377 157.6
[M+Na]+ 272.12571 164.6
[M-H]- 248.12921 160.0
[M+NH4]+ 267.17031 174.4
[M+K]+ 288.09965 161.5
[M+H-H2O]+ 232.13375 151.2
[M+HCOO]- 294.13469 180.0
[M+CH3COO]- 308.15034 196.9
[M+Na-2H]- 270.11116 159.6
[M]+ 249.13594 160.0
[M]- 249.13704 160.0
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.