Kopsinine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR300234
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR300234 contains the MS2 mass spectrum of Kopsinine with the InChIkey IYLRRIUNGGQRTN-GKCDKPGPSA-N.
Source: Kopsinine
Chemical Info
InChI | InChI=1S/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18?,19+,20+,21+/m0/s1 |
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SMILES | COC(=O)[C@@H]1C[C@]23CCCN4CC[C@]5(C24)C2=CC=CC=C2N[C@]15CC3 |
InChI Key | IYLRRIUNGGQRTN-GKCDKPGPSA-N |
Molecular Formula | C21H26N2O2 |
Exact Mass | 338.451 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 | 77bca00e-3f06-413f-82d3-1dbf9c27847d |
Package id | msbnk-riken-pr300234 |
Resource type | HTML |
State | active |