| SpectraBase Compound ID | 4AtcEsiCi2e |
|---|---|
| InChI | InChI=1S/C12H12O6/c1-12(2)8(14)11(16)18-9(12)7(13)6-4-3-5-17-10(6)15/h3-5,8-9,14H,1-2H3 |
| InChIKey | NRVJYYWHKIVWSC-UHFFFAOYSA-N |
| Mol Weight | 252.22 g/mol |
| Molecular Formula | C12H12O6 |
| Exact Mass | 252.063388 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Co01tJI66SF |
|---|---|
| Name | (S)-(-)-pantolactone ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O6 |
| InChI | InChI=1S/C12H12O6/c1-12(2)8(14)11(16)18-9(12)7(13)6-4-3-5-17-10(6)15/h3-5,8-9,14H,1-2H3 |
| InChIKey | NRVJYYWHKIVWSC-UHFFFAOYSA-N |
| Molecular Weight | 252.222 g/mol |
| SMILES | OC1C(C(C(C=2C(OC=CC2)=O)=O)OC1=O)(C)C |
| SPLASH | splash10-00di-2900000000-3df0a9ec2e7bc2d510a0 |
| Source of Spectrum | F-50-4568-9 |
| Wiley ID | 1255187 |