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2-[4-(2-tert-butoxy-2-keto-ethyl)-1,4,7-triazonan-1-yl]acetic acid tert-butyl ester
SpectraBase Compound ID 1Gu1CdCBOc5
InChI InChI=1S/C18H35N3O4/c1-17(2,3)24-15(22)13-20-9-7-19-8-10-21(12-11-20)14-16(23)25-18(4,5)6/h19H,7-14H2,1-6H3
InChIKey KAGBCHRKKXTZOY-UHFFFAOYSA-N
Mol Weight 357.5 g/mol
Molecular Formula C18H35N3O4
Exact Mass 357.262757 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F8QWSAXUoK1
Name 2-[4-(2-tert-butoxy-2-keto-ethyl)-1,4,7-triazonan-1-yl]acetic acid tert-butyl ester
Compound Number (TERT.-BUTYL)2NO2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H35N3O4
InChI InChI=1S/C18H35N3O4/c1-17(2,3)24-15(22)13-20-9-7-19-8-10-21(12-11-20)14-16(23)25-18(4,5)6/h19H,7-14H2,1-6H3
InChIKey KAGBCHRKKXTZOY-UHFFFAOYSA-N
Literature Reference Author J.HUSKENS,A.D.SHERRY
Literature Reference Citation J.AM.CHEM.SOC.,118,4396(1996)
Literature Reference DOI 10.1021/ja953771p
Molecular Weight 357.494 g/mol
Sample ID 55758
Solvent CDCl3