![4a-Hydroxy-4-nitrotetradecahydrobenzo[a]cyclododecen-1(2H)-one](/api/spectrum/EEZq7U4ZJsp/structure.png?h=300&w=458 "4a-Hydroxy-4-nitrotetradecahydrobenzo[a]cyclododecen-1(2H)-one")
| SpectraBase Compound ID | IALfT0ZWB8R |
|---|---|
| InChI | InChI=1S/C16H27NO4/c18-14-10-11-15(17(20)21)16(19)12-8-6-4-2-1-3-5-7-9-13(14)16/h13,15,19H,1-12H2 |
| InChIKey | XXJQRTXAOCTZMY-UHFFFAOYSA-N |
| Mol Weight | 297.39 g/mol |
| Molecular Formula | C16H27NO4 |
| Exact Mass | 297.194008 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EEZq7U4ZJsp |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C16H27NO4 |
| InChI | InChI=1S/C16H27NO4/c18-14-10-11-15(17(20)21)16(19)12-8-6-4-2-1-3-5-7-9-13(14)16/h13,15,19H,1-12H2 |
| InChIKey | XXJQRTXAOCTZMY-UHFFFAOYSA-N |
| Molecular Weight | 297.1933 |
| SMILES | OC12C(N(=O)=O)CCC(=O)C1CCCCCCCCCC2 |
| SPLASH | splash10-052b-9410000000-7678c6f87cb52a750b76 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |