CID 6434082

Brn 2154225

Structural Information

Molecular Formula
C14H19NO5
SMILES
COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)NCCO
InChI
InChI=1S/C14H19NO5/c1-18-11-8-10(4-5-13(17)15-6-7-16)9-12(19-2)14(11)20-3/h4-5,8-9,16H,6-7H2,1-3H3,(H,15,17)/b5-4+
InChIKey
ASJISPPWLSJQIS-SNAWJCMRSA-N
Compound name
(E)-N-(2-hydroxyethyl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

281.1263 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.13358 163.1
[M+Na]+ 304.11552 169.8
[M-H]- 280.11902 165.5
[M+NH4]+ 299.16012 178.5
[M+K]+ 320.08946 168.0
[M+H-H2O]+ 264.12356 156.2
[M+HCOO]- 326.12450 186.0
[M+CH3COO]- 340.14015 200.6
[M+Na-2H]- 302.10097 165.3
[M]+ 281.12575 168.4
[M]- 281.12685 168.4
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