3-Thiophenecarboxylic acid
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fiocruz-FIO00391
Dataset description:
This MassBank record with Accession MSBNK-Fiocruz-FIO00391 contains the MS2 mass spectrum of 3-Thiophenecarboxylic acid with the InChIkey YNVOMSDITJMNET-UHFFFAOYSA-N.
Source: 3-Thiophenecarboxylic acid
Chemical Info
InChI | InChI=1S/C5H4O2S/c6-5(7)4-1-2-8-3-4/h1-3H,(H,6,7) |
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SMILES | OC(=O)c(c1)csc1 |
InChI Key | YNVOMSDITJMNET-UHFFFAOYSA-N |
Molecular Formula | C5H4O2S |
Exact Mass | 127.993 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 4.0 International (CC BY-NC 4.0) |
Id | b8165cfc-04ca-405c-a2e0-6b7e6f5a4801 |
Package id | msbnk-fiocruz-fio00391 |
Resource type | HTML |
State | active |