Pinolenic acid
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS004020
Dataset description:
This MassBank record with Accession MSBNK-BS-BS004020 contains the MS2 mass spectrum of Pinolenic acid with the InChIkey HXQHFNIKBKZGRP-URPRIDOGSA-N.
Source: Pinolenic acid
Chemical Info
| InChI | InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,13-14H,2-5,8,11-12,15-17H2,1H3,(H,19,20)/b7-6-,10-9-,14-13- |
|---|---|
| SMILES | C(C(C(C(C(/C(=C(\C(/C(=C(\C(C(/C(=C(\C(C(C(C(=O)O[H])([H])[H])([H])[H])([H])[H])/[H])/[H])([H])[H])([H])[H])/[H])/[H])([H])[H])/[H])/[H])([H])[H])([H])[H])([H])[H])([H])[H])([H])([H])[H] |
| InChI Key | HXQHFNIKBKZGRP-URPRIDOGSA-N |
| Molecular Formula | C18H30O2 |
| Exact Mass | 278.225 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 | b5554ada-e901-4a7b-992d-6f65806fce48 |
| Package id | msbnk-bs-bs004020 |
| Resource type | HTML |
| State | active |