| SpectraBase Compound ID | 1zFyq6UhCR1 |
|---|---|
| InChI | InChI=1S/C16H23NOS/c1-10(2)12-5-6-16(4,17-9-19)14-8-15(18)11(3)7-13(12)14/h7,10,12-14H,5-6,8H2,1-4H3/t12-,13-,14-,16-/m1/s1 |
| InChIKey | ODUZQPVIXXXOEL-IXYNUQLISA-N |
| Mol Weight | 277.43 g/mol |
| Molecular Formula | C16H23NOS |
| Exact Mass | 277.150036 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J75I4EuqJbS |
|---|---|
| Name | AXINISOTHIOCYANATE_L |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H23NOS |
| InChI | InChI=1S/C16H23NOS/c1-10(2)12-5-6-16(4,17-9-19)14-8-15(18)11(3)7-13(12)14/h7,10,12-14H,5-6,8H2,1-4H3/t12-,13-,14-,16-/m1/s1 |
| InChIKey | ODUZQPVIXXXOEL-IXYNUQLISA-N |
| Literature Reference Author | E.ZUBIA,M.J.ORTEGA,C.J.HERNANDEZ-GUERRERO,J.L.CARBALLO |
| Literature Reference Citation | J.NAT.PROD.,71,608(2008) |
| Literature Reference DOI | 10.1021/np070593s |
| Molecular Weight | 277.425 g/mol |
| Sample ID | 28203 |
| Solvent | CDCl3 |