CID 95817

7192-50-9

Structural Information

Molecular Formula
C17H25NO2
SMILES
CCCC1=CC(=CC(=C1OCC=C)CCC)C(=O)NC
InChI
InChI=1S/C17H25NO2/c1-5-8-13-11-15(17(19)18-4)12-14(9-6-2)16(13)20-10-7-3/h7,11-12H,3,5-6,8-10H2,1-2,4H3,(H,18,19)
InChIKey
SYEHSVXQXQHIQV-UHFFFAOYSA-N
Compound name
N-methyl-4-prop-2-enoxy-3,5-dipropylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.18854 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.195816 167.8
[M+Na]+ 298.177758 174.0
[M-H]- 274.181264 171.1
[M+NH4]+ 293.222363 184.4
[M+K]+ 314.151698 170.5
[M+H-H2O]+ 258.185800 160.9
[M+HCOO]- 320.186741 190.5
[M+CH3COO]- 334.202391 206.4
[M+Na-2H]- 296.163206 168.7
[M]+ 275.18799142 171.8
[M]- 275.18908858 171.8
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.