| SpectraBase Spectrum ID |
6qq7QWoGpZH |
| Name |
6-Chloranyl-2,2,8,8-tetramethyl-9,10-dihydro-4H-pyrano[2,3-H]chromen-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
294.102272169 u |
| Formula |
C16H19ClO3 |
| InChI |
InChI=1S/C16H19ClO3/c1-15(2)6-5-10-13-9(7-11(17)14(10)19-15)8-12(18)16(3,4)20-13/h7H,5-6,8H2,1-4H3 |
| InChIKey |
SLXOEDVVTOFBPF-UHFFFAOYSA-N |
| SMILES |
C12=C3C(OC(CC3)(C)C)=C(C=C1CC(=O)C(O2)(C)C)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.891163 |
![6-chloranyl-2,2,8,8-tetramethyl-9,10-dihydro-4H-pyrano[2,3-h]chromen-3-one](/api/spectrum/6qq7QWoGpZH/structure.png?h=300&w=458 "6-chloranyl-2,2,8,8-tetramethyl-9,10-dihydro-4H-pyrano[2,3-h]chromen-3-one")
