CID 216154

N-methacryloyltyramine

Structural Information

Molecular Formula
C12H15NO2
SMILES
CC(=C)C(=O)NCCC1=CC=C(C=C1)O
InChI
InChI=1S/C12H15NO2/c1-9(2)12(15)13-8-7-10-3-5-11(14)6-4-10/h3-6,14H,1,7-8H2,2H3,(H,13,15)
InChIKey
VGFIPNNZCAAAMJ-UHFFFAOYSA-N
Compound name
N-[2-(4-hydroxyphenyl)ethyl]-2-methylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

205.11028 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.117556 146.8
[M+Na]+ 228.099498 152.7
[M-H]- 204.103004 148.9
[M+NH4]+ 223.144103 164.8
[M+K]+ 244.073438 149.9
[M+H-H2O]+ 188.107540 140.7
[M+HCOO]- 250.108481 168.8
[M+CH3COO]- 264.124131 187.2
[M+Na-2H]- 226.084946 150.0
[M]+ 205.10973142 145.6
[M]- 205.11082858 145.6
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

patents stripe