| SpectraBase Spectrum ID |
Iuv4JPoi3Jk |
| Name |
9-Hydroxy-10-(4'-isopropylcinnamoyl)-2,2,6,6-tetramethyltetrahydrobenzo[1,2-B:3,4-B']dipyran |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
434.245709571 u |
| Formula |
C28H34O4 |
| InChI |
InChI=1S/C28H34O4/c1-17(2)19-10-7-18(8-11-19)9-12-22(29)23-24(30)20-13-15-27(3,4)31-25(20)21-14-16-28(5,6)32-26(21)23/h7-12,17,30H,13-16H2,1-6H3/b12-9+ |
| InChIKey |
NJCMXUXRPXLVPQ-FMIVXFBMSA-N |
| Molecular Weight |
434.576 g/mol |
| SMILES |
C=1(C2=C(CCC(O2)(C)C)C2=C(C1O)CCC(C)(C)O2)C(\C=C\C=1C=CC(=CC1)C(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971166 |
![9-Hydroxy-10-(4'-isopropylcinnamoyl)-2,2,6,6-tetramethyltetrahydrobenzo[1,2-b:3,4-b']dipyran](/api/spectrum/Iuv4JPoi3Jk/structure.png?h=300&w=458 "9-Hydroxy-10-(4'-isopropylcinnamoyl)-2,2,6,6-tetramethyltetrahydrobenzo[1,2-b:3,4-b']dipyran")
