| SpectraBase Compound ID | 1Fye5y4HjhS |
|---|---|
| InChI | InChI=1S/C23H24O7/c1-14(26-20(24)15-10-6-4-7-11-15)17-18(19-22(28-17)30-23(2,3)29-19)27-21(25)16-12-8-5-9-13-16/h4-14,17-19,22H,1-3H3/t14-,17-,18-,19-,22-/m1/s1 |
| InChIKey | NTBLJMVOTZWSPN-DHSNVRAJSA-N |
| Mol Weight | 412.44 g/mol |
| Molecular Formula | C23H24O7 |
| Exact Mass | 412.152203 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7JbnkeFgb0 |
|---|---|
| Name | .alpha.-D-Allofuranose, 6-deoxy-1,2-O-(1-methylethylidene)-, dibenzoate |
| Alternate Name(s) | Furo[2,3-d]-1,3-dioxole, .alpha.-D-allofuranose deriv. 3,5-di-O-benzoyl-6-deoxy-1,2-O-(1-methylethylidene)-.alpha.-D-allofuranose 6-Desoxy-3,5-O-dibenzoyl-1,2-O-isopropyliden-.alpha.-allofuranose benzoic acid[(3aR,5R,6R,6aR)-5-[(1R)-1-benzoyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]ester [(3aR,5R,6R,6aR)-2,2-dimethyl-5-[(1R)-1-(phenylcarbonyloxy)ethyl]-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]benzoate [(3aR,5R,6R,6aR)-5-[(1R)-1-benzoyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]benzoate [(3aR,5R,6R,6aR)-5-[(1R)-1-benzoyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] benzoate [(3aR,5R,6R,6aR)-2,2-dimethyl-5-[(1R)-1-(phenylcarbonyloxy)ethyl]-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] benzoate |
| CAS Registry Number | 89128-39-2 |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H24O7 |
| InChI | InChI=1S/C23H24O7/c1-14(26-20(24)15-10-6-4-7-11-15)17-18(19-22(28-17)30-23(2,3)29-19)27-21(25)16-12-8-5-9-13-16/h4-14,17-19,22H,1-3H3/t14-,17-,18-,19-,22-/m1/s1 |
| InChIKey | NTBLJMVOTZWSPN-DHSNVRAJSA-N |
| Molecular Weight | 412.438 g/mol |
| SMILES | [C@]12([C@@]([C@@]([C@](OC(=O)c3ccccc3)(C)[H])(O[C@@]1(OC(O2)(C)C)[H])[H])(OC(=O)c1ccccc1)[H])[H] |
| SPLASH | splash10-0002-0029000000-af25c3c6fe0f46bf798a |
| Source of Spectrum | AH-121-686-8 |
| Wiley ID | 1374450 |