| SpectraBase Compound ID | 81q5j0SA5ou |
|---|---|
| InChI | InChI=1S/C28H36O15/c1-11-21(34)23(36)25(38)27(40-11)43-26-24(37)22(35)19(10-29)42-28(26)41-13-8-16(32)20(17(33)9-13)14(30)5-3-12-4-6-18(39-2)15(31)7-12/h4,6-9,11,19,21-29,31-38H,3,5,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1 |
| InChIKey | ITVGXXMINPYUHD-CUVHLRMHSA-N |
| Mol Weight | 612.6 g/mol |
| Molecular Formula | C28H36O15 |
| Exact Mass | 612.20542 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 3YexLKjy5fv |
|---|---|
| Name | Neohesperidin dihydrochalcone |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | W381101 |
| Lot Number | 06405JE |
| CAS Registry Number | 20702-77-6 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H36O15 |
| InChI | InChI=1S/C28H36O15/c1-11-21(34)23(36)25(38)27(40-11)43-26-24(37)22(35)19(10-29)42-28(26)41-13-8-16(32)20(17(33)9-13)14(30)5-3-12-4-6-18(39-2)15(31)7-12/h4,6-9,11,19,21-29,31-38H,3,5,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1 |
| InChIKey | ITVGXXMINPYUHD-CUVHLRMHSA-N |
| Molecular Weight | 612.581 g/mol |
| Purity | >=85% |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Synonyms | 1-(4-((2-O-[6-Deoxy-alpha-L-mannopyranosyl]-beta-D-glucopyranosyl)oxy)-2,6-dihydroxyphenyl)-3-[3-hydroxy-4-methoxyphenyl]-1-propanone |
| Wiley ID | SIAL_FF-FTIR_001993 |