CID 3032050

10-undecynamide, n-((4-hydroxy-3-methoxyphenyl)methyl)-

Structural Information

Molecular Formula
C19H27NO3
SMILES
COC1=C(C=CC(=C1)CNC(=O)CCCCCCCCC#C)O
InChI
InChI=1S/C19H27NO3/c1-3-4-5-6-7-8-9-10-11-19(22)20-15-16-12-13-17(21)18(14-16)23-2/h1,12-14,21H,4-11,15H2,2H3,(H,20,22)
InChIKey
KIFSWRNTGICWRI-UHFFFAOYSA-N
Compound name
N-[(4-hydroxy-3-methoxyphenyl)methyl]undec-10-ynamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

317.1991 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.20638 176.7
[M+Na]+ 340.18832 186.0
[M+NH4]+ 335.23292 178.8
[M+K]+ 356.16226 176.2
[M-H]- 316.19182 169.4
[M+Na-2H]- 338.17377 176.9
[M]+ 317.19855 174.9
[M]- 317.19965 174.9
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.