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Methyl 12-([(ethoxycarbonyl)sulfanyl]methyl)-15-isopropyl-6-(methoxycarbonyl)-4,10,13-trioxo-3-oxa-5,11,14-triazahexadecan-16-oate

View entire compound with spectra: 4 MS (GC)

Methyl 12-([(ethoxycarbonyl)sulfanyl]methyl)-15-isopropyl-6-(methoxycarbonyl)-4,10,13-trioxo-3-oxa-5,11,14-triazahexadecan-16-oate
SpectraBase Compound ID 2wlW60YzR7J
InChI InChI=1S/C22H37N3O10S/c1-7-34-21(30)24-14(19(28)32-5)10-9-11-16(26)23-15(12-36-22(31)35-8-2)18(27)25-17(13(3)4)20(29)33-6/h13-15,17H,7-12H2,1-6H3,(H,23,26)(H,24,30)(H,25,27)
InChIKey SVBPHWNHZPAVQC-UHFFFAOYSA-N
Mol Weight 535.6 g/mol
Molecular Formula C22H37N3O10S
Exact Mass 535.219966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID cv0ljdwsPI
Name
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Formula C22H36N3O10SD
InChI InChI=1S/C22H37N3O10S/c1-7-34-21(30)24-14(19(28)32-5)10-9-11-16(26)23-15(12-36-22(31)35-8-2)18(27)25-17(13(3)4)20(29)33-6/h13-15,17H,7-12H2,1-6H3,(H,23,26)(H,24,30)(H,25,27)
InChIKey SVBPHWNHZPAVQC-UHFFFAOYSA-N
Molecular Weight 535.2190
SMILES N(C(CCCC(NC(C(NC(C(OC)=O)C(C)C)=O)CSC(OCC)=O)=O)C(OC)=O)C(=O)OCC
SPLASH splash10-0a7j-9531000000-e41372809b6ad973ef55
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany