CID 31129

Brn 1155231

Structural Information

Molecular Formula
C15H21N3O3
SMILES
C1COCCN1CCNC(=O)C2CNC3=CC=CC=C3O2
InChI
InChI=1S/C15H21N3O3/c19-15(16-5-6-18-7-9-20-10-8-18)14-11-17-12-3-1-2-4-13(12)21-14/h1-4,14,17H,5-11H2,(H,16,19)
InChIKey
BIIXKXLZKHSKGB-UHFFFAOYSA-N
Compound name
N-(2-morpholin-4-ylethyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.1583 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.16558 170.2
[M+Na]+ 314.14752 180.4
[M+NH4]+ 309.19212 176.7
[M+K]+ 330.12146 175.1
[M-H]- 290.15102 175.2
[M+Na-2H]- 312.13297 173.4
[M]+ 291.15775 172.7
[M]- 291.15885 172.7
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.