CID 5315911

N-cinnamoyltyramine

Structural Information

Molecular Formula
C17H17NO2
SMILES
C1=CC=C(C=C1)/C=C/C(=O)NCCC2=CC=C(C=C2)O
InChI
InChI=1S/C17H17NO2/c19-16-9-6-15(7-10-16)12-13-18-17(20)11-8-14-4-2-1-3-5-14/h1-11,19H,12-13H2,(H,18,20)/b11-8+
InChIKey
KGOYCHSKGXJDND-DHZHZOJOSA-N
Compound name
(E)-N-[2-(4-hydroxyphenyl)ethyl]-3-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

9
References

85
Patents

267.12592 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.13320 164.4
[M+Na]+ 290.11514 177.1
[M+NH4]+ 285.15974 171.9
[M+K]+ 306.08908 169.1
[M-H]- 266.11864 168.4
[M+Na-2H]- 288.10059 172.6
[M]+ 267.12537 167.2
[M]- 267.12647 167.2
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

patents stripe