CID 6434361

N-(2-hydroxyethyl)-2-methoxycinnamamide

Structural Information

Molecular Formula
C12H15NO3
SMILES
COC1=CC=CC=C1/C=C/C(=O)NCCO
InChI
InChI=1S/C12H15NO3/c1-16-11-5-3-2-4-10(11)6-7-12(15)13-8-9-14/h2-7,14H,8-9H2,1H3,(H,13,15)/b7-6+
InChIKey
RESCTOBKYJIMHJ-VOTSOKGWSA-N
Compound name
(E)-N-(2-hydroxyethyl)-3-(2-methoxyphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

221.1052 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.11248 149.6
[M+Na]+ 244.09442 155.6
[M-H]- 220.09792 151.6
[M+NH4]+ 239.13902 167.0
[M+K]+ 260.06836 152.9
[M+H-H2O]+ 204.10246 143.1
[M+HCOO]- 266.10340 172.8
[M+CH3COO]- 280.11905 187.7
[M+Na-2H]- 242.07987 154.0
[M]+ 221.10465 150.4
[M]- 221.10575 150.4
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