Rauwolscine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR301508
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR301508 contains the MS2 mass spectrum of Rauwolscine with the InChIkey BLGXFZZNTVWLAY-UHFFFAOYSA-N.
Source: Rauwolscine
Chemical Info
InChI | InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3 |
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SMILES | COC(=O)C1C(O)CCC2CN3CCC4=C(NC5=CC=CC=C45)C3CC12 |
InChI Key | BLGXFZZNTVWLAY-UHFFFAOYSA-N |
Molecular Formula | C21H26N2O3 |
Exact Mass | 354.450 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 | f42a0476-c364-4b20-bedd-63ac787cb292 |
Package id | msbnk-riken-pr301508 |
Resource type | HTML |
State | active |