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Tert-Butyl 2-((R)-5-(allyloxy)-4-diazo-1-((S)-4-methyl phenylsulfinamido)-3,5-dioxopentyl)-1H-indole-1-carboxylate
SpectraBase Compound ID AjM54JVuwB4
InChI InChI=1S/C28H30N4O6S/c1-6-15-37-26(34)25(30-29)24(33)17-21(31-39(36)20-13-11-18(2)12-14-20)23-16-19-9-7-8-10-22(19)32(23)27(35)38-28(3,4)5/h6-14,16,21,31H,1,15,17H2,2-5H3/t21-,39?/m1/s1
InChIKey DVPLZQNEQMAVCT-KIQDXCFYSA-N
Mol Weight 550.63 g/mol
Molecular Formula C28H30N4O6S
Exact Mass 550.188606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9fJj2apJ7m6
Name Tert-Butyl 2-((R)-5-(allyloxy)-4-diazo-1-((S)-4-methyl phenylsulfinamido)-3,5-dioxopentyl)-1H-indole-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H30N4O6S
InChI InChI=1S/C28H30N4O6S/c1-6-15-37-26(34)25(30-29)24(33)17-21(31-39(36)20-13-11-18(2)12-14-20)23-16-19-9-7-8-10-22(19)32(23)27(35)38-28(3,4)5/h6-14,16,21,31H,1,15,17H2,2-5H3/t21-,39?/m1/s1
InChIKey DVPLZQNEQMAVCT-KIQDXCFYSA-N
Literature Reference DOI 10.1002/cjoc.201200672
Molecular Weight 550.630 g/mol
SMILES N([C@@](c1[n](C(OC(C)(C)C)=O)c2c(c1)cccc2)(CC(=O)C(=[N+]=[N-])C(=O)OCC=C)[H])[S@](c1ccc(C)cc1)=O
SPLASH splash10-0006-9430000000-ddb187db9837847df28b
Source of Spectrum CJC-30-2300-17
Synonyms tert-Butyl 2-((R)-5-(allyloxy)-4-diazo-1-((S)-4-methylphenylsulfinamido)-3,5-dioxopentyl)-1H-indole-1-carboxylate (E,5R)-2-diazonio-5-[[(S)-(4-methylphenyl)sulfinyl]amino]-5-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-indolyl]-1-oxo-1-prop-2-enoxy-2-penten-3-olate (E,5R)-2-diazonio-5-[[(S)-(4-methylphenyl)sulfinyl]amino]-5-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]-1-oxo-1-prop-2-enoxypent-2-en-3-olate (E,5R)-1-allyloxy-5-(1-tert-butoxycarbonylindol-2-yl)-2-diazonio-1-oxo-5-[[(S)-p-tolylsulfinyl]amino]pent-2-en-3-olate (E,5R)-2-diazonio-5-[[(S)-(4-methylphenyl)sulfinyl]amino]-5-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]-1-oxidanylidene-1-prop-2-enoxy-pent-2-en-3-olate
Wiley ID 1772632