| SpectraBase Compound ID | 2dvTKSEh89L |
|---|---|
| InChI | InChI=1S/C16H14O/c1-9-10(2)16-14-8-12-6-4-3-5-11(12)7-13(14)15(9)17-16/h3-6,15-16H,1-2,7-8H2 |
| InChIKey | LHBRMDJWPXFJBN-UHFFFAOYSA-N |
| Mol Weight | 222.29 g/mol |
| Molecular Formula | C16H14O |
| Exact Mass | 222.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2k6zhUnsYYs |
|---|---|
| Name | 1,4-Epoxyanthracene, 1,2,3,4,9,10-hexahydro-2,3-bis(methylene)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.104465070 u |
| Formula | C16H14O |
| InChI | InChI=1S/C16H14O/c1-9-10(2)16-14-8-12-6-4-3-5-11(12)7-13(14)15(9)17-16/h3-6,15-16H,1-2,7-8H2 |
| InChIKey | LHBRMDJWPXFJBN-UHFFFAOYSA-N |
| Molecular Weight | 222.287 g/mol |
| SMILES | C12=C(C3OC2C(C3=C)=C)CC2=C(C1)C=CC=C2 |