1-Methylsulfinylbutenyl isothiocyante
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR303468
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR303468 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 |
|---|---|
| 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 |
|---|---|
| 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 | 959cddaf-23d3-459d-96e6-df79389583a0 |
| Package id | msbnk-riken-pr303468 |
| Resource type | HTML |
| State | active |