| SpectraBase Compound ID | FfgN24jigH1 |
|---|---|
| InChI | InChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,17-18H,1-3,8-14H2,4-6H3/t17-,18-,20+/m0/s1 |
| InChIKey | KYLKKZSVPLUGCC-CMKODMSKSA-N |
| Mol Weight | 272.5 g/mol |
| Molecular Formula | C20H32 |
| Exact Mass | 272.250401 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Fcf1zkcVgUX |
|---|---|
| Name | Sclarene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H32 |
| InChI | InChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,17-18H,1-3,8-14H2,4-6H3/t17-,18-,20+/m0/s1 |
| InChIKey | KYLKKZSVPLUGCC-CMKODMSKSA-N |
| Instrument Name | Agilent 6890-5975 series |
| Ionization Type | EI |
| Molecular Weight | 272.476 g/mol |
| SMILES | C1CC(C)(C)[C@]2([H])CCC(=C)[C@](CCC(C=C)=C)([C@@]2(C)C1)[H] |
| SPLASH | splash10-0a4i-0290000000-ecfaab1523bdc1f85b4b |
| Source of Spectrum | WO2017001641A1 |
| Wiley ID | 1855380 |