| SpectraBase Compound ID | O7xFN3WiaU |
|---|---|
| InChI | InChI=1S/C14H7Cl3O5/c1-3-2-4(18)7(15)13-5(3)10(19)6-11(20)8(16)12(21)9(17)14(6)22-13/h2,18,20-21H,1H3 |
| InChIKey | NTAXLEHKEDVPRK-UHFFFAOYSA-N |
| Mol Weight | 361.56 g/mol |
| Molecular Formula | C14H7Cl3O5 |
| Exact Mass | 359.935906 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DnpB6Rp6cSB |
|---|---|
| Name | 9H-Xanthen-9-one, 2,4,5-trichloro-1,3,6-trihydroxy-8-methyl- |
| CAS Registry Number | 20716-96-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H7Cl3O5 |
| InChI | InChI=1S/C14H7Cl3O5/c1-3-2-4(18)7(15)13-5(3)10(19)6-11(20)8(16)12(21)9(17)14(6)22-13/h2,18,20-21H,1H3 |
| InChIKey | NTAXLEHKEDVPRK-UHFFFAOYSA-N |
| Molecular Weight | 361.564 g/mol |
| SMILES | Oc1c(c(c(c2c1C(c1c(cc(c(c1O2)Cl)O)C)=O)Cl)O)Cl |
| SPLASH | splash10-03di-4419000000-f6f1da7154b9b3a01050 |
| Source of Spectrum | N-30-487-6 |
| Synonyms | Xanthen-9-one, 2,4,5-trichloro-1,3,6-trihydroxy-8-methyl- 2,4,5-Trichloro-1,3,6-trihydroxy-8-methyl-9H-xanthen-9-one 2,4,5-trichloro-1,3,6-trihydroxy-8-methyl-9-xanthenone 2,4,5-trichloro-1,3,6-trihydroxy-8-methyl-xanthen-9-one 2,4,5-trichloro-1,3,6-trihydroxy-8-methyl-xanthone 2,4,5-tris(chloranyl)-8-methyl-1,3,6-tris(oxidanyl)xanthen-9-one 9H-Xanthen-9-one, 2,4,7-trichloro-1,3,6-trihydroxy-8-methyl- Arthothelin Xanthen-9-one, 2,4,7-trichloro-1,3,6-trihydroxy-8-methyl- |
| Wiley ID | 1347996 |