CID 2788350

N-(3-methoxyphenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide

Structural Information

Molecular Formula
C16H15NO4
SMILES
COC1=CC=CC(=C1)NC(=O)C2COC3=CC=CC=C3O2
InChI
InChI=1S/C16H15NO4/c1-19-12-6-4-5-11(9-12)17-16(18)15-10-20-13-7-2-3-8-14(13)21-15/h2-9,15H,10H2,1H3,(H,17,18)
InChIKey
ZUKFSNIIUFBPOL-UHFFFAOYSA-N
Compound name
N-(3-methoxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

0
Patents

285.1001 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.107376 163.6
[M+Na]+ 308.089318 169.7
[M-H]- 284.092824 172.2
[M+NH4]+ 303.133923 176.9
[M+K]+ 324.063258 169.3
[M+H-H2O]+ 268.097360 155.2
[M+HCOO]- 330.098301 183.3
[M+CH3COO]- 344.113951 201.8
[M+Na-2H]- 306.074766 171.1
[M]+ 285.09955142 164.9
[M]- 285.10064858 164.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.