SpectraBase Compound ID | CV4jsZYoCC1 |
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InChI | InChI=1S/C15H22N2O3S/c1-3-4-11(2)20-13-7-5-12(6-8-13)17-15(21)16-10-9-14(18)19/h5-8,11H,3-4,9-10H2,1-2H3,(H,18,19)(H2,16,17,21) |
InChIKey | NXPVPJWDPFQTEX-UHFFFAOYSA-N |
Mol Weight | 310.41 g/mol |
Molecular Formula | C15H22N2O3S |
Exact Mass | 310.135114 g/mol |
SpectraBase Spectrum ID | FdEEmbVXIyM |
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Name | 3-{3-{p-[(1-methylbutyl)oxy]phenyl}-2-thioureido}propionic acid |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C15H22N2O3S |
InChI | InChI=1S/C15H22N2O3S/c1-3-4-11(2)20-13-7-5-12(6-8-13)17-15(21)16-10-9-14(18)19/h5-8,11H,3-4,9-10H2,1-2H3,(H,18,19)(H2,16,17,21) |
InChIKey | NXPVPJWDPFQTEX-UHFFFAOYSA-N |
Sadtler IR Number | 31085 |
Sadtler UV Number | 13130N |
Solvent | Methanol |