SpectraBase Spectrum ID |
J6nDp7OW6KG |
Name |
3-Bromo-1,6,9-trimethyl-4-phenyl-1-azaspiro[4.5]deca-3,6,9-triene-2,8-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
357.036441757 u |
Formula |
C18H16BrNO2 |
InChI |
InChI=1S/C18H16BrNO2/c1-11-10-18(12(2)9-14(11)21)15(13-7-5-4-6-8-13)16(19)17(22)20(18)3/h4-10H,1-3H3 |
InChIKey |
RYEREQAMUPXEJX-UHFFFAOYSA-N |
Molecular Weight |
358.235 g/mol |
SMILES |
C12(N(C)C(=O)C(Br)=C2C2=CC=CC=C2)C(=CC(=O)C(C)=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.843921 |