Gardnerine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR300361
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR300361 contains the MS2 mass spectrum of Gardnerine with the InChIkey RBALEJFQJCAPLN-RFEOFLAMSA-N.
Source: Gardnerine
Chemical Info
InChI | InChI=1S/C20H24N2O2/c1-3-11-9-22-18-8-15-13-5-4-12(24-2)6-17(13)21-20(15)19(22)7-14(11)16(18)10-23/h3-6,14,16,18-19,21,23H,7-10H2,1-2H3/b11-3-/t14?,16?,18?,19-/m0/s1 |
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SMILES | COC1=CC2=C(C=C1)C1=C(N2)[C@@H]2CC3C(CO)C(C1)N2C\C3=C\C |
InChI Key | RBALEJFQJCAPLN-RFEOFLAMSA-N |
Molecular Formula | C20H24N2O2 |
Exact Mass | 324.424 g/mol |
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Additional Information
Field | Value |
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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 | 7aacbaeb-c6a8-42f6-819c-d52427d901c0 |
Package id | msbnk-riken-pr300361 |
Resource type | HTML |
State | active |