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Ethyl 4-[(tert-butoxycarbonyl)(ethoxycarbonyl)amino]-6-methyl-2-heptynoate
SpectraBase Compound ID 8sMgDl2IeJ6
InChI InChI=1S/C18H29NO6/c1-8-23-15(20)11-10-14(12-13(3)4)19(16(21)24-9-2)17(22)25-18(5,6)7/h13-14H,8-9,12H2,1-7H3
InChIKey KLSQIKYZHMJZLW-UHFFFAOYSA-N
Mol Weight 355.43 g/mol
Molecular Formula C18H29NO6
Exact Mass 355.199488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K5In87b61zj
Name Ethyl 4-[(tert-butoxycarbonyl)(ethoxycarbonyl)amino]-6-methyl-2-heptynoate
Alternate Name(s) 2-Aza-hex-4-yne-1,6-dioic acid, 1-t-butyl ester 6- ethyl ester, N-ethoxycarbonyl-3-isobutyl- 4-[ethoxycarbonyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-methyl-2-heptynoic acid ethyl ester 4-[tert-butoxycarbonyl(carbethoxy)amino]-6-methyl-hept-2-ynoic acid ethyl ester Ethyl 4-[ethoxycarbonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-methyl-hept-2-ynoate Ethyl 4-[tert-butoxycarbonyl(ethoxycarbonyl)amino]-6-methyl-hept-2-ynoate
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Formula C18H29NO6
InChI InChI=1S/C18H29NO6/c1-8-23-15(20)11-10-14(12-13(3)4)19(16(21)24-9-2)17(22)25-18(5,6)7/h13-14H,8-9,12H2,1-7H3
InChIKey KLSQIKYZHMJZLW-UHFFFAOYSA-N
Molecular Weight 355.431 g/mol
SMILES CC(CC(C#CC(OCC)=O)N(C(=O)OC(C)(C)C)C(=O)OCC)C
SPLASH splash10-0a4i-9510000000-8865c551580df42f5ad7
Wiley ID 1492808