| SpectraBase Compound ID | LIbIijA1kPI |
|---|---|
| InChI | InChI=1S/C35H55ClO3/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-22-27-31-35(38)39-32(6-3)28-24-23-26-30-34(37)33(36)29-25-21-10-8-5-2/h6,12-13,15-16,32-34,37H,3-5,7-11,14,17-22,25,27,29-31H2,1-2H3/b13-12+,16-15+ |
| InChIKey | GNNHXGCYCDTSGG-XUPYMNJSSA-N |
| Mol Weight | 559.3 g/mol |
| Molecular Formula | C35H55ClO3 |
| Exact Mass | 558.383973 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6AUCirq8Hej |
|---|---|
| Name | 10-CHLORO-1-HEPTADECEN-4,6-DIYNE-3,9-DIOL 3-LINOLEATE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C35H55ClO3 |
| InChI | InChI=1S/C35H55ClO3/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-22-27-31-35(38)39-32(6-3)28-24-23-26-30-34(37)33(36)29-25-21-10-8-5-2/h6,12-13,15-16,32-34,37H,3-5,7-11,14,17-22,25,27,29-31H2,1-2H3/b13-12+,16-15+ |
| InChIKey | GNNHXGCYCDTSGG-XUPYMNJSSA-N |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |