Mabuterol
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU110204
Dataset description:
This MassBank record with Accession MSBNK-Athens_Univ-AU110204 contains the MS2 mass spectrum of Mabuterol with the InChIkey JSJCTEKTBOKRST-UHFFFAOYSA-N.
Source: Mabuterol
Chemical Info
| InChI | InChI=1S/C13H18ClF3N2O/c1-12(2,3)19-6-10(20)7-4-8(13(15,16)17)11(18)9(14)5-7/h4-5,10,19-20H,6,18H2,1-3H3 |
|---|---|
| SMILES | CC(C)(C)NCC(c1cc(c(c(c1)Cl)N)C(F)(F)F)O |
| InChI Key | JSJCTEKTBOKRST-UHFFFAOYSA-N |
| Molecular Formula | C13H18ClF3N2O |
| Exact Mass | 310.106 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 | 9dc64682-de7d-46de-bc77-3c9417bea2e0 |
| Package id | msbnk-athens_univ-au110204 |
| Resource type | HTML |
| State | active |