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(R)-2-[1-[(R)-(1-N-TERT.-BUTOXYCARBONYL-AMINO)-ISOBUTYLTHIAZOLE-4-CARBONYL]-AMINO]-ETHYLTHIAZOLE-4-CARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID fQEkXsZrJ0
InChI InChI=1S/C21H30N4O5S2/c1-8-29-19(27)14-10-31-17(24-14)12(4)22-16(26)13-9-32-18(23-13)15(11(2)3)25-20(28)30-21(5,6)7/h9-12,15H,8H2,1-7H3,(H,22,26)(H,25,28)/t12-,15-/m0/s1
InChIKey FPBNTCODLUAKIB-WFASDCNBSA-N
Mol Weight 482.61 g/mol
Molecular Formula C21H30N4O5S2
Exact Mass 482.165762 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AthMXVhEAXX
Name (R)-2-[1-[(R)-(1-N-TERT.-BUTOXYCARBONYL-AMINO)-ISOBUTYLTHIAZOLE-4-CARBONYL]-AMINO]-ETHYLTHIAZOLE-4-CARBOXYLIC-ACID-ETHYLESTER
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30N4O5S2
InChI InChI=1S/C21H30N4O5S2/c1-8-29-19(27)14-10-31-17(24-14)12(4)22-16(26)13-9-32-18(23-13)15(11(2)3)25-20(28)30-21(5,6)7/h9-12,15H,8H2,1-7H3,(H,22,26)(H,25,28)/t12-,15-/m0/s1
InChIKey FPBNTCODLUAKIB-WFASDCNBSA-N
Literature Reference Author Z.XIA,C.D.SMITH
Literature Reference Citation J.ORG.CHEM.,66,3459(2001)
Literature Reference DOI 10.1021/jo005783l
Molecular Weight 482.613 g/mol
Solvent CDCl3
Source File Reference UWMS26918