Flindersine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML01221
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML01221 contains the MS2 mass spectrum of Flindersine with the InChIkey PXNMNABLQWUMCX-UHFFFAOYSA-N.
Source: Flindersine
Chemical Info
| InChI | InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16) |
|---|---|
| SMILES | CC1(C=CC2=C(O1)C3=CC=CC=C3NC2=O)C |
| InChI Key | PXNMNABLQWUMCX-UHFFFAOYSA-N |
| Molecular Formula | C14H13NO2 |
| Exact Mass | 227.095 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 | 57fce999-c81e-4e48-a1d4-6925190df6b3 |
| Package id | msbnk-washington_state_univ-bml01221 |
| Resource type | HTML |
| State | active |