CID 3024383

Brn 2597503

Structural Information

Molecular Formula
C20H31NO2
SMILES
CCCC1=CC(=C(C(=C1OCC=C)CC)C)C(=O)N(CC)CC
InChI
InChI=1S/C20H31NO2/c1-7-12-16-14-18(20(22)21(10-4)11-5)15(6)17(9-3)19(16)23-13-8-2/h8,14H,2,7,9-13H2,1,3-6H3
InChIKey
TWXSMDJXTCKSTP-UHFFFAOYSA-N
Compound name
N,N,3-triethyl-2-methyl-4-prop-2-enoxy-5-propylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

317.23547 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.24275 181.2
[M+Na]+ 340.22469 192.1
[M+NH4]+ 335.26929 187.5
[M+K]+ 356.19863 184.8
[M-H]- 316.22819 183.2
[M+Na-2H]- 338.21014 184.6
[M]+ 317.23492 183.2
[M]- 317.23602 183.2
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.