Stearic acid
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS003930
Dataset description:
This MassBank record with Accession MSBNK-BS-BS003930 contains the MS mass spectrum of Stearic acid with the InChIkey QIQXTHQIDYTFRH-UHFFFAOYSA-N.
Source: Stearic acid
Chemical Info
InChI | InChI=1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20) |
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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])[H])([H])[H])([H])([H])[H] |
InChI Key | QIQXTHQIDYTFRH-UHFFFAOYSA-N |
Molecular Formula | C18H36O2 |
Exact Mass | 284.272 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 | 69c76c1c-fa6d-49d1-ac4e-73513b2129df |
Package id | msbnk-bs-bs003930 |
Resource type | HTML |
State | active |