| SpectraBase Compound ID | 3lCF3OcZFe1 |
|---|---|
| InChI | InChI=1S/C14H15NO5/c1-8-5-13(19)20-14-9(8)3-4-11(16)10(14)6-15(2)7-12(17)18/h3-5,16H,6-7H2,1-2H3,(H,17,18) |
| InChIKey | MGGUJKYUDQUTSV-UHFFFAOYSA-N |
| Mol Weight | 277.28 g/mol |
| Molecular Formula | C14H15NO5 |
| Exact Mass | 277.095023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FqDnumu4d3u |
|---|---|
| Name | Methyl calcein blue |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.095022582 u |
| Formula | C14H15NO5 |
| InChI | InChI=1S/C14H15NO5/c1-8-5-13(19)20-14-9(8)3-4-11(16)10(14)6-15(2)7-12(17)18/h3-5,16H,6-7H2,1-2H3,(H,17,18) |
| InChIKey | MGGUJKYUDQUTSV-UHFFFAOYSA-N |
| SMILES | C1=2C(CN(CC(=O)O)C)=C(O)C=CC2C(C)=CC(O1)=O |