LORATADINE
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UPAO-UPA00015
Dataset description:
This MassBank record with Accession MSBNK-UPAO-UPA00015 contains the MS2 mass spectrum of LORATADINE with the InChIkey JCCNYMKQOSZNPW-UHFFFAOYSA-N.
Source: LORATADINE
Chemical Info
| InChI | InChI=1S/C22H23ClN2O2/c1-2-27-22(26)25-12-9-15(10-13-25)20-19-8-7-18(23)14-17(19)6-5-16-4-3-11-24-21(16)20/h3-4,7-8,11,14H,2,5-6,9-10,12-13H2,1H3 |
|---|---|
| SMILES | CCOC(=O)N(C4)CCC(C4)=C(c21)c(c3)c(cc(Cl)c3)CCc(cccn2)1 |
| InChI Key | JCCNYMKQOSZNPW-UHFFFAOYSA-N |
| Molecular Formula | C22H23ClN2O2 |
| Exact Mass | 382.145 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 4.0 International (CC BY 4.0) |
| Id | cf6ebafd-eb37-4d69-b5eb-79105984f839 |
| Package id | msbnk-upao-upa00015 |
| Resource type | HTML |
| State | active |