| SpectraBase Compound ID | Bwa2aisZHPV |
|---|---|
| InChI | InChI=1S/C12H14O4/c1-6-4-9-10(7(2)5-15-9)11(14)12(6)16-8(3)13/h5-6,12H,4H2,1-3H3/t6-,12-/m0/s1 |
| InChIKey | LUROOFSVNUUOCG-QTTZVWFDSA-N |
| Mol Weight | 222.24 g/mol |
| Molecular Formula | C12H14O4 |
| Exact Mass | 222.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ht9BIWIeuu |
|---|---|
| Name | (-)-CALAMINTHONE |
| Compound Number | 26 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C12H14O4/c1-6-4-9-10(7(2)5-15-9)11(14)12(6)16-8(3)13/h5-6,12H,4H2,1-3H3/t6-,12-/m0/s1 |
| InChIKey | LUROOFSVNUUOCG-QTTZVWFDSA-N |
| Literature Reference | NAT.PROD.VOL.1 A.UR-RAHMAN,V.U.AHMAD |
| Solvent | Chloroform-d |