| SpectraBase Compound ID | FrvUxcoXExT |
|---|---|
| InChI | InChI=1S/C14H18N2O2S/c1-15-9-13(16(17)18)7-11-5-3-4-6-12(11)14(8-13,10-15)19-2/h3-6H,7-10H2,1-2H3 |
| InChIKey | GUMBSJSNXDJOKU-UHFFFAOYSA-N |
| Mol Weight | 278.37 g/mol |
| Molecular Formula | C14H18N2O2S |
| Exact Mass | 278.108899 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ElKsTQT84O8 |
|---|---|
| Name | 3-METHYL-1-METHYLSULFANYL-5-NITRO-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANO-3-BENZOAZOCINE |
| Compound Number | 9 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C14H18N2O2S/c1-15-9-13(16(17)18)7-11-5-3-4-6-12(11)14(8-13,10-15)19-2/h3-6H,7-10H2,1-2H3 |
| InChIKey | GUMBSJSNXDJOKU-UHFFFAOYSA-N |
| Literature Reference | K.J.BLACKALL,D.HENDRY,R.J.PRYCE,S.M.ROBERTS J.CHEM.SOC.PERKIN-1,2767(1995) |
| Solvent | Chloroform-d |