| SpectraBase Spectrum ID |
BAIAPtGdjpY |
| Name |
6-Bromanyl-3-[(4-chlorophenyl)methyl]-2,4-dihydro-1,3-benzoxazine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.986904742 u |
| Formula |
C15H13BrClNO |
| InChI |
InChI=1S/C15H13BrClNO/c16-13-3-6-15-12(7-13)9-18(10-19-15)8-11-1-4-14(17)5-2-11/h1-7H,8-10H2 |
| InChIKey |
GHGJWVFTDNYODN-UHFFFAOYSA-N |
| Molecular Weight |
338.632 g/mol |
| SMILES |
C=1C(=CC=C2C1CN(CC1=CC=C(C=C1)Cl)CO2)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.801707 |
![6-Bromanyl-3-[(4-chlorophenyl)methyl]-2,4-dihydro-1,3-benzoxazine](/api/spectrum/BAIAPtGdjpY/structure.png?h=300&w=458 "6-Bromanyl-3-[(4-chlorophenyl)methyl]-2,4-dihydro-1,3-benzoxazine")
