| SpectraBase Spectrum ID |
DrNXt51Kk0X |
| Name |
1,8-dihydroxy-3-(4-hydroxy-3-methylol-but-2-enoxy)-6-methyl-xanthone |
| Alternate Name(s) |
1,8-dihydroxy-3-[4-hydroxy-3-(hydroxymethyl)but-2-enoxy]-6-methyl-9-xanthenone
1,8-dihydroxy-3-[4-hydroxy-3-(hydroxymethyl)but-2-enoxy]-6-methyl-xanthen-9-one
3-[3-(hydroxymethyl)-4-oxidanyl-but-2-enoxy]-6-methyl-1,8-bis(oxidanyl)xanthen-9-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H18O7 |
| InChI |
InChI=1S/C19H18O7/c1-10-4-13(22)17-15(5-10)26-16-7-12(6-14(23)18(16)19(17)24)25-3-2-11(8-20)9-21/h2,4-7,20-23H,3,8-9H2,1H3 |
| InChIKey |
DKSIXSIYOLEDDG-UHFFFAOYSA-N |
| Molecular Weight |
358.346 g/mol |
| SMILES |
Oc1cc(OCC=C(CO)CO)cc2Oc3c(C(c12)=O)c(cc(c3)C)O |
| SPLASH |
splash10-0a4i-0093000000-1a229624ffaf184b2716 |
| Source of Spectrum |
G4-63-20-10 |
| Wiley ID |
1608197 |
