CID 6434088

30687-20-8

Structural Information

Molecular Formula
C14H19NO4
SMILES
COC1=CC=C(C=C1)/C=C/C(=O)N(CCO)CCO
InChI
InChI=1S/C14H19NO4/c1-19-13-5-2-12(3-6-13)4-7-14(18)15(8-10-16)9-11-17/h2-7,16-17H,8-11H2,1H3/b7-4+
InChIKey
ZOEUMARXBZTMSR-QPJJXVBHSA-N
Compound name
(E)-N,N-bis(2-hydroxyethyl)-3-(4-methoxyphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.1314 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.13868 161.9
[M+Na]+ 288.12062 166.7
[M-H]- 264.12412 163.6
[M+NH4]+ 283.16522 177.3
[M+K]+ 304.09456 164.6
[M+H-H2O]+ 248.12866 154.9
[M+HCOO]- 310.12960 183.6
[M+CH3COO]- 324.14525 196.8
[M+Na-2H]- 286.10607 164.1
[M]+ 265.13085 164.3
[M]- 265.13195 164.3
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

No patent data available for this compound.