![5,6,7,8-Tetrahydro-4H-[1,2,5]oxadiazolo[3,4-c]azepin-4-one 1-oxide](/api/spectrum/46ZPwhvlS1U/structure.png?h=300&w=458 "5,6,7,8-Tetrahydro-4H-[1,2,5]oxadiazolo[3,4-c]azepin-4-one 1-oxide")
| SpectraBase Compound ID | 1X6Wgu1sycF |
|---|---|
| InChI | InChI=1S/C6H7N3O3/c10-6-5-4(2-1-3-7-6)9(11)12-8-5/h1-3H2,(H,7,10) |
| InChIKey | DLNXQWKSSBBFKY-UHFFFAOYSA-N |
| Mol Weight | 169.14 g/mol |
| Molecular Formula | C6H7N3O3 |
| Exact Mass | 169.048741 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 46ZPwhvlS1U |
|---|---|
| Name | 5,6,7,8-Tetrahydro-4H-[1,2,5]oxadiazolo[3,4-c]azepin-4-one 1-oxide |
| CAS Registry Number | 330982-48-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H7N3O3 |
| InChI | InChI=1S/C6H7N3O3/c10-6-5-4(2-1-3-7-6)9(11)12-8-5/h1-3H2,(H,7,10) |
| InChIKey | DLNXQWKSSBBFKY-UHFFFAOYSA-N |
| Molecular Weight | 169.140 g/mol |
| SMILES | N1CCCc2c(C1=O)no[n+]2[O-] |
| SPLASH | splash10-0gb9-9100000000-400e6e3d0fed90b6e525 |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | 1,2,5-Oxadiazolo[3,4-c]-1H-azepin-4-one, 4,6,7,8-tetrahydro-, 1-oxide 1-Oxidanidyl-5,6,7,8-tetrahydro-[1,2,5]oxadiazolo[3,4-c]azepin-1-ium-4-one 1-Oxido-5,6,7,8-tetrahydro-[1,2,5]oxadiazolo[3,4-c]azepin-1-ium-4-one 1-Oxido-5,6,7,8-tetrahydrofurazan[3,4-c]azepin-1-ium-4-one 4-Oxo-5,6,7,8-tetrahydrofurazano[4,5-c]azepin-1-oxide |
| Wiley ID | 1421567 |