1-Methylsulfinylbutenyl isothiocyante
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR303462
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR303462 contains the MS2 mass spectrum of 1-Methylsulfinylbutenyl isothiocyante with the InChIkey QKGJFQMGPDVOQE-UHFFFAOYSA-N.
Chemical Info
InChI | InChI=1S/C6H9NOS2/c1-10(8)5-3-2-4-7-6-9/h3,5H,2,4H2,1H3 |
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SMILES | CS(=O)C=CCCN=C=S |
InChI Key | QKGJFQMGPDVOQE-UHFFFAOYSA-N |
Molecular Formula | C6H9NOS2 |
Exact Mass | 175.274 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-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
Id | 1a1f120d-c89e-48d7-9a4b-eed1e59a7d9a |
Package id | msbnk-riken-pr303462 |
Resource type | HTML |
State | active |