| SpectraBase Compound ID | AFMhyZ1TrM3 |
|---|---|
| InChI | InChI=1S/C21H18O7/c1-11-7-14(26-20(11)23)9-21(2)15(28-21)10-25-19-17-13(5-6-24-17)8-12-3-4-16(22)27-18(12)19/h3-8,14-15H,9-10H2,1-2H3 |
| InChIKey | CISFAPDYRQPRCZ-UHFFFAOYSA-N |
| Mol Weight | 382.37 g/mol |
| Molecular Formula | C21H18O7 |
| Exact Mass | 382.105253 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CcCDbOG4MeW |
|---|---|
| Name | 2',3'-Epoxyindicolactone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 382.105252913 u |
| Formula | C21H18O7 |
| InChI | InChI=1S/C21H18O7/c1-11-7-14(26-20(11)23)9-21(2)15(28-21)10-25-19-17-13(5-6-24-17)8-12-3-4-16(22)27-18(12)19/h3-8,14-15H,9-10H2,1-2H3 |
| InChIKey | CISFAPDYRQPRCZ-UHFFFAOYSA-N |
| Molecular Weight | 382.368 g/mol |
| SMILES | C1(=C2OC(C=CC2=CC2=C1OC=C2)=O)OCC1C(CC2OC(C(=C2)C)=O)(C)O1 |