CID 16062456

N,n-dhma cpd

Structural Information

Molecular Formula
C18H27NO3
SMILES
CCCCN(CCCC)C(=O)/C=C/C1=CC(=C(C=C1)O)OC
InChI
InChI=1S/C18H27NO3/c1-4-6-12-19(13-7-5-2)18(21)11-9-15-8-10-16(20)17(14-15)22-3/h8-11,14,20H,4-7,12-13H2,1-3H3/b11-9+
InChIKey
PXZYOFGPOVZUTN-PKNBQFBNSA-N
Compound name
(E)-N,N-dibutyl-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

305.1991 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.206376 176.6
[M+Na]+ 328.188318 181.2
[M-H]- 304.191824 179.4
[M+NH4]+ 323.232923 191.6
[M+K]+ 344.162258 178.5
[M+H-H2O]+ 288.196360 169.1
[M+HCOO]- 350.197301 198.3
[M+CH3COO]- 364.212951 210.4
[M+Na-2H]- 326.173766 176.4
[M]+ 305.19855142 181.3
[M]- 305.19964858 181.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.