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N-ACETYL-CYSTEINE-[S-(E,E)-3,7-DIMETHYL-2,6-OCTADIENE-8-AZIDE)-METHYLESTER;DESIRED-PRODUCT
SpectraBase Compound ID dKyd5nSGN1
InChI InChI=1S/C16H26N4O3S/c1-12(6-5-7-13(2)10-18-20-17)8-9-24-11-15(16(22)23-4)19-14(3)21/h7-8,15H,5-6,9-11H2,1-4H3,(H,19,21)/b12-8+,13-7+/t15-/m0/s1
InChIKey AUCUFPDRAQQWEO-UHMYVSDBSA-N
Mol Weight 354.47 g/mol
Molecular Formula C16H26N4O3S
Exact Mass 354.172562 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KXAyDTsFr4j
Name N-ACETYL-CYSTEINE-[S-(E,E)-3,7-DIMETHYL-2,6-OCTADIENE-8-AZIDE)-METHYLESTER;DESIRED-PRODUCT
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H26N4O3S
InChI InChI=1S/C16H26N4O3S/c1-12(6-5-7-13(2)10-18-20-17)8-9-24-11-15(16(22)23-4)19-14(3)21/h7-8,15H,5-6,9-11H2,1-4H3,(H,19,21)/b12-8+,13-7+/t15-/m0/s1
InChIKey AUCUFPDRAQQWEO-UHMYVSDBSA-N
Literature Reference Author T.A.KALE,M.D.DISTEFANO
Literature Reference Citation ORG.LETTERS,5,609(2003)
Literature Reference DOI 10.1021/ol026752a
Molecular Weight 354.467 g/mol
Sample ID 49469
Solvent CDCl3