Acetochlor-ESA
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU203001
Dataset description:
This MassBank record with Accession MSBNK-Athens_Univ-AU203001 contains the MS2 mass spectrum of Acetochlor-ESA with the InChIkey HXAIQOCRALNGKB-UHFFFAOYSA-N.
Source: Acetochlor-ESA
Chemical Info
| InChI | InChI=1S/C14H21NO5S/c1-4-12-8-6-7-11(3)14(12)15(10-20-5-2)13(16)9-21(17,18)19/h6-8H,4-5,9-10H2,1-3H3,(H,17,18,19) |
|---|---|
| SMILES | CCOCN(C(=O)CS(O)(=O)=O)C1=C(C)C=CC=C1CC |
| InChI Key | HXAIQOCRALNGKB-UHFFFAOYSA-N |
| Molecular Formula | C14H21NO5S |
| Exact Mass | 315.114 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-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | f2995ea5-fed8-4548-9030-e4485ba455bb |
| Package id | msbnk-athens_univ-au203001 |
| Resource type | HTML |
| State | active |