Boldine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR301098
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR301098 contains the MS2 mass spectrum of Boldine with the InChIkey LZJRNLRASBVRRX-ZDUSSCGKSA-N.
Source: Boldine
Chemical Info
| InChI | InChI=1S/C19H21NO4/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3/t13-/m0/s1 |
|---|---|
| SMILES | COC1=C(O)C=C2C[C@@H]3N(C)CCC4=CC(O)=C(OC)C(C2=C1)=C34 |
| InChI Key | LZJRNLRASBVRRX-ZDUSSCGKSA-N |
| Molecular Formula | C19H21NO4 |
| Exact Mass | 327.380 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-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
| Id | 15986d08-ac44-48e2-aa63-4a788d2b0947 |
| Package id | msbnk-riken-pr301098 |
| Resource type | HTML |
| State | active |