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]+ 276.19582 167.8
[M+Na]+ 298.17776 174.0
[M-H]- 274.18126 171.1
[M+NH4]+ 293.22236 184.4
[M+K]+ 314.15170 170.5
[M+H-H2O]+ 258.18580 160.9
[M+HCOO]- 320.18674 190.5
[M+CH3COO]- 334.20239 206.4
[M+Na-2H]- 296.16321 168.7
[M]+ 275.18799 171.8
[M]- 275.18909 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.