T-2 tetraol
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000627
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000627 contains the MS2 mass spectrum of T-2 tetraol with the InChIkey ZAXZBJSXSOISTF-ZSTBYQRGSA-N.
Source: T-2 tetraol
Chemical Info
| InChI | InChI=1S/C15H22O6/c1-7-3-9-14(5-16,4-8(7)17)13(2)11(19)10(18)12(21-9)15(13)6-20-15/h3,8-12,16-19H,4-6H2,1-2H3/t8-,9+,10+,11+,12+,13+,14+,15?/m0/s1 |
|---|---|
| SMILES | CC1=C[C@@H]2[C@](C[C@@H]1O)([C@]3([C@@H]([C@H]([C@H](C34CO4)O2)O)O)C)CO |
| InChI Key | ZAXZBJSXSOISTF-ZSTBYQRGSA-N |
| Molecular Formula | C15H22O6 |
| Exact Mass | 298.142 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 7347c748-8f0c-45b9-bc41-62b9ede28445 |
| Package id | msbnk-aafc-ac000627 |
| Resource type | HTML |
| State | active |