| SpectraBase Spectrum ID |
lFZKOKMvM1 |
| Name |
2H,6H-Benzo[1,2-B:5,4-B']dipyran, 7,8-dihydro-8,8-dimethyl-2-(4-methylphenyl)-3-nitro- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
351.147058156 u |
| Formula |
C21H21NO4 |
| InChI |
InChI=1S/C21H21NO4/c1-13-4-6-14(7-5-13)20-17(22(23)24)11-16-10-15-8-9-21(2,3)26-19(15)12-18(16)25-20/h4-7,10-12,20H,8-9H2,1-3H3 |
| InChIKey |
HAURSJFDIOUXJY-UHFFFAOYSA-N |
| Molecular Weight |
351.402 g/mol |
| SMILES |
C1(N(=O)=O)=CC2=CC=3CCC(OC3C=C2OC1C1=CC=C(C=C1)C)(C)C |
![2H,6H-Benzo[1,2-b:5,4-b']dipyran, 7,8-dihydro-8,8-dimethyl-2-(4-methylphenyl)-3-nitro-](/api/spectrum/lFZKOKMvM1/structure.png?h=300&w=458 "2H,6H-Benzo[1,2-b:5,4-b']dipyran, 7,8-dihydro-8,8-dimethyl-2-(4-methylphenyl)-3-nitro-")
