KU60648_BTP_M2
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UoB-XB000201
Dataset description:
This MassBank record with Accession MSBNK-UoB-XB000201 contains the MS2 mass spectrum of KU60648_BTP_M2 with the InChIkey GPSOIIUVPZLZJB-UHFFFAOYSA-N.
Source: KU60648_BTP_M2
Chemical Info
| InChI | InChI=1S/C25H20N2O3S/c26-19-9-8-16(25-23(19)18-4-1-2-7-21(18)31-25)15-5-3-6-17-20(28)14-22(30-24(15)17)27-10-12-29-13-11-27/h1-9,14H,10-13,26H2 |
|---|---|
| SMILES | O=C1C=C(N2CCOCC2)OC3=C1C=CC=C3C4=C(SC5=CC=CC=C56)C6=C(N[H])C=C4 |
| InChI Key | GPSOIIUVPZLZJB-UHFFFAOYSA-N |
| Molecular Formula | C25H20N2O3S |
| Exact Mass | 428.120 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 | c2c50aca-d6fd-4fd0-9c3d-0cd402cc9a4f |
| Package id | msbnk-uob-xb000201 |
| Resource type | HTML |
| State | active |