SpectraBase Compound ID | 9DhMNoaN4bX |
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InChI | InChI=1S/C29H50N4O2S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-19-26(2)31-32-29(36)30-27-20-22-28(23-21-27)37(34,35)33-24-17-15-18-25-33/h20-23H,3-19,24-25H2,1-2H3,(H2,30,32,36)/b31-26+ |
InChIKey | QHXFBEUJWPFONQ-GKPLWNPISA-N |
Mol Weight | 550.9 g/mol |
Molecular Formula | C29H50N4O2S2 |
Exact Mass | 550.337519 g/mol |
SpectraBase Spectrum ID | 3QElsXptbO5 |
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Name | 2-heptadecanone, 4-[p-(piperidinosulfonyl)phenyl]thiosemicarbazone |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C29H50N4O2S2 |
InChI | InChI=1S/C29H50N4O2S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-19-26(2)31-32-29(36)30-27-20-22-28(23-21-27)37(34,35)33-24-17-15-18-25-33/h20-23H,3-19,24-25H2,1-2H3,(H2,30,32,36)/b31-26+ |
InChIKey | QHXFBEUJWPFONQ-GKPLWNPISA-N |
Sadtler IR Number | 38746 |
Sadtler UV Number | 22216N |
Solvent | Methanol |