| SpectraBase Compound ID | 2ruG8fYT0J6 |
|---|---|
| InChI | InChI=1S/C12H17NO3/c1-7(2)12-15-5-9-4-13-8(3)11(14)10(9)6-16-12/h4,7,12,14H,5-6H2,1-3H3 |
| InChIKey | JTDBGJWBSDBUQB-UHFFFAOYSA-N |
| Mol Weight | 223.27 g/mol |
| Molecular Formula | C12H17NO3 |
| Exact Mass | 223.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IM8c2OpePTl |
|---|---|
| Name | 5-Isopropyl-1'-hydroxy-2'-methyl-4,6-dioxa-pyrido-cycloheptene |
| CAS Registry Number | 1622-67-9 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H17NO3 |
| InChI | InChI=1S/C12H17NO3/c1-7(2)12-15-5-9-4-13-8(3)11(14)10(9)6-16-12/h4,7,12,14H,5-6H2,1-3H3 |
| InChIKey | JTDBGJWBSDBUQB-UHFFFAOYSA-N |
| Instrument Name | Bruker WM-360 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |