Coniine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-NaToxAq-NA001129
Dataset description:
This MassBank record with Accession MSBNK-NaToxAq-NA001129 contains the MS2 mass spectrum of Coniine with the InChIkey NDNUANOUGZGEPO-QMMMGPOBSA-N.
Source: Coniine
Chemical Info
InChI | InChI=1S/C8H17N/c1-2-5-8-6-3-4-7-9-8/h8-9H,2-7H2,1H3/t8-/m0/s1 |
---|---|
SMILES | CCC[C@H]1CCCCN1 |
InChI Key | NDNUANOUGZGEPO-QMMMGPOBSA-N |
Molecular Formula | C8H17N |
Exact Mass | 127.136 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 4.0 International (CC BY 4.0) |
Id | 4f6ad0e3-8a21-41af-8001-6f4e11e2a737 |
Package id | msbnk-natoxaq-na001129 |
Resource type | HTML |
State | active |