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(+/-)-(1alpha,2alpha,5alpha)-6-(2,4-DIMETHOXYBENZYL)-4,7-DIOXO-2-METHYL-3-OXA-6-AZABICYCLO[3.2.0]HEPTANE-5-CARBOXYLIC ACID

View entire compound with spectra: 2 NMR, and 1 FTIR

(+/-)-(1alpha,2alpha,5alpha)-6-(2,4-DIMETHOXYBENZYL)-4,7-DIOXO-2-METHYL-3-OXA-6-AZABICYCLO[3.2.0]HEPTANE-5-CARBOXYLIC ACID
SpectraBase Compound ID IGyzY5teKhM
InChI InChI=1S/C16H17NO7/c1-8-12-13(18)17(16(12,14(19)20)15(21)24-8)7-9-4-5-10(22-2)6-11(9)23-3/h4-6,8,12H,7H2,1-3H3,(H,19,20)/t8-,12-,16-/s2
InChIKey PPOWGGLEKMSZNU-MONCZQQWSA-N
Mol Weight 335.31 g/mol
Molecular Formula C16H17NO7
Exact Mass 335.100502 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JUzzJSskcSt
Name (+/-)-(1alpha,2alpha,5alpha)-6-(2,4-DIMETHOXYBENZYL)-4,7-DIOXO-2-METHYL-3-OXA-6-AZABICYCLO[3.2.0]HEPTANE-5-CARBOXYLIC ACID
Source of Sample M. Shiozaki, Sankyo Company, Ltd., Tokyo, Japan
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO7
InChI InChI=1S/C16H17NO7/c1-8-12-13(18)17(16(12,14(19)20)15(21)24-8)7-9-4-5-10(22-2)6-11(9)23-3/h4-6,8,12H,7H2,1-3H3,(H,19,20)/t8-,12-,16-/s2
InChIKey PPOWGGLEKMSZNU-MONCZQQWSA-N
Melting Point 169-172C
Molecular Weight 335.32
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20