5-hydroxyculmorin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000100
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000100 contains the MS2 mass spectrum of 5-hydroxyculmorin with the InChIkey XFKGEQRMYJCXFK-YTAGIEBCSA-N.
Source: 5-hydroxyculmorin
Chemical Info
| InChI | InChI=1S/C15H26O3/c1-13(2)9(17)5-6-14(3)10-8(16)7-15(14,4)12(18)11(10)13/h8-12,16-18H,5-7H2,1-4H3/t8-,9-,10+,11+,12?,14-,15-/m1/s1 |
|---|---|
| SMILES | C[C@@]12CC[C@H](C([C@H]3[C@@H]1[C@@H](C[C@@]2(C3O)C)O)(C)C)O |
| InChI Key | XFKGEQRMYJCXFK-YTAGIEBCSA-N |
| Molecular Formula | C15H26O3 |
| Exact Mass | 254.188 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 | 5640460d-bd0c-433b-9d6a-f985b21e2e42 |
| Package id | msbnk-aafc-ac000100 |
| Resource type | HTML |
| State | active |