| SpectraBase Compound ID | 6vAxRYGsqX1 |
|---|---|
| InChI | InChI=1S/C15H22O3/c1-10-4-5-13(2)12(6-10)18-15(9-16)8-11(17)7-14(13,15)3/h6,12,16H,4-5,7-9H2,1-3H3/t12-,13-,14+,15-/m0/s1 |
| InChIKey | JJBMWLFFOIHRLZ-XQLPTFJDSA-N |
| Mol Weight | 250.34 g/mol |
| Molecular Formula | C15H22O3 |
| Exact Mass | 250.156895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5cPBiZyCuGu |
|---|---|
| Name | 3-KETOAPOTRICHOTHECENE |
| CAS Registry Number | 122470-39-7 |
| Comments | see also:J.Org.Chem.,54,4313 (1989) |
| Compound Number | 566 |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C15H22O3/c1-10-4-5-13(2)12(6-10)18-15(9-16)8-11(17)7-14(13,15)3/h6,12,16H,4-5,7-9H2,1-3H3/t12-,13-,14+,15-/m0/s1 |
| InChIKey | JJBMWLFFOIHRLZ-XQLPTFJDSA-N |
| Literature Reference | NAT.PROD.VOL.1 A.UR-RAHMAN,V.U.AHMAD |
| Solvent | Chloroform-d |