CID 4128163

2-(benzylamino)-n-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide

Structural Information

Molecular Formula
C17H18N2O3
SMILES
C1COC2=C(O1)C=CC(=C2)NC(=O)CNCC3=CC=CC=C3
InChI
InChI=1S/C17H18N2O3/c20-17(12-18-11-13-4-2-1-3-5-13)19-14-6-7-15-16(10-14)22-9-8-21-15/h1-7,10,18H,8-9,11-12H2,(H,19,20)
InChIKey
JHUGNHUKZQDDIL-UHFFFAOYSA-N
Compound name
2-(benzylamino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.13174 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.13902 170.8
[M+Na]+ 321.12096 183.1
[M+NH4]+ 316.16556 178.7
[M+K]+ 337.09490 176.2
[M-H]- 297.12446 178.8
[M+Na-2H]- 319.10641 177.5
[M]+ 298.13119 174.7
[M]- 298.13229 174.7
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.