| SpectraBase Compound ID | 370U3inlSZ8 |
|---|---|
| InChI | InChI=1S/C16H24Br2ClNO2/c1-9-7-10(22-13(20)21)12(17)14(2,3)16(9)6-5-15(4,18)11(19)8-16/h10-12H,1,5-8H2,2-4H3,(H2,20,21)/t10-,11-,12-,15-,16+/m0/s1 |
| InChIKey | GBESDORXXJSBAV-PVIIJVKYSA-N |
| Mol Weight | 457.63 g/mol |
| Molecular Formula | C16H24Br2ClNO2 |
| Exact Mass | 454.986233 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1kUTIR2LQqr |
|---|---|
| Name | ISOOBTUSOL-9-CARBAMATE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H24Br2ClNO2 |
| InChI | InChI=1S/C16H24Br2ClNO2/c1-9-7-10(22-13(20)21)12(17)14(2,3)16(9)6-5-15(4,18)11(19)8-16/h10-12H,1,5-8H2,2-4H3,(H2,20,21)/t10-,11-,12-,15-,16+/m0/s1 |
| InChIKey | GBESDORXXJSBAV-PVIIJVKYSA-N |
| Literature Reference Author | K.L.LANG,I.T.SILVA,L.A.ZIMMERMANN,C.LHULLIER,M.V.M.ARANA,J.A .PALERMO |
| Literature Reference Citation | MAR.DRUGS,10,2254(2012) |
| Literature Reference DOI | 10.3390/md10102254 |
| Molecular Weight | 457.633 g/mol |
| Source File Reference | UWIR6038 |