![5H-Cyclodec[b]indole, 6,7,8,9,10,11,12,13-octahydro-3-nitro-](/api/spectrum/7Qkd1ZxLRcK/structure.png?h=300&w=458 "5H-Cyclodec[b]indole, 6,7,8,9,10,11,12,13-octahydro-3-nitro-")
| SpectraBase Compound ID | 9SbzPyR24Am |
|---|---|
| InChI | InChI=1S/C16H20N2O2/c19-18(20)12-9-10-14-13-7-5-3-1-2-4-6-8-15(13)17-16(14)11-12/h9-11,17H,1-8H2 |
| InChIKey | DDPQDFCTDNXUFC-UHFFFAOYSA-N |
| Mol Weight | 272.35 g/mol |
| Molecular Formula | C16H20N2O2 |
| Exact Mass | 272.152478 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Qkd1ZxLRcK |
|---|---|
| Name | 5H-Cyclodec[B]indole, 6,7,8,9,10,11,12,13-octahydro-3-nitro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.152477890 u |
| Formula | C16H20N2O2 |
| InChI | InChI=1S/C16H20N2O2/c19-18(20)12-9-10-14-13-7-5-3-1-2-4-6-8-15(13)17-16(14)11-12/h9-11,17H,1-8H2 |
| InChIKey | DDPQDFCTDNXUFC-UHFFFAOYSA-N |
| Molecular Weight | 272.348 g/mol |
| SMILES | C1=2NC3=C(C2C=CC(N(=O)=O)=C1)CCCCCCCC3 |