CID 203128

13973-71-2

Structural Information

Molecular Formula
C14H17NO5
SMILES
C=CCNC(=O)OCC(C1COC2=CC=CC=C2O1)O
InChI
InChI=1S/C14H17NO5/c1-2-7-15-14(17)19-8-10(16)13-9-18-11-5-3-4-6-12(11)20-13/h2-6,10,13,16H,1,7-9H2,(H,15,17)
InChIKey
VCTNHPKSHQKNAO-UHFFFAOYSA-N
Compound name
[2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxyethyl] N-prop-2-enylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.1107 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.11798 163.6
[M+Na]+ 302.09992 172.9
[M+NH4]+ 297.14452 169.4
[M+K]+ 318.07386 169.1
[M-H]- 278.10342 166.6
[M+Na-2H]- 300.08537 165.4
[M]+ 279.11015 165.4
[M]- 279.11125 165.4
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

No patent data available for this compound.