Isopropalin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01137804
Dataset description:
This MassBank record with Accession MSBNK-Eawag-EQ01137804 contains the MS2 mass spectrum of Isopropalin with the InChIkey NEKOXWSIMFDGMA-UHFFFAOYSA-N.
Source: Isopropalin
Chemical Info
| InChI | InChI=1S/C15H23N3O4/c1-5-7-16(8-6-2)15-13(17(19)20)9-12(11(3)4)10-14(15)18(21)22/h9-11H,5-8H2,1-4H3 |
|---|---|
| SMILES | CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])C(C)C)[N+](=O)[O-] |
| InChI Key | NEKOXWSIMFDGMA-UHFFFAOYSA-N |
| Molecular Formula | C15H23N3O4 |
| Exact Mass | 309.169 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 | 16cca7f5-7583-416b-93f6-099f919817b7 |
| Package id | msbnk-eawag-eq01137804 |
| Resource type | HTML |
| State | active |