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(1rs,4rs,6rs)-9-Benzyl-4-benzyloxymethyl-9-aza-3,8-dioxabicyclo[4.3.0]nonane

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(1rs,4rs,6rs)-9-Benzyl-4-benzyloxymethyl-9-aza-3,8-dioxabicyclo[4.3.0]nonane
SpectraBase Compound ID 17wV80ZHyfD
InChI InChI=1S/C21H25NO3/c1-3-7-17(8-4-1)12-22-21-16-24-20(11-19(21)14-25-22)15-23-13-18-9-5-2-6-10-18/h1-10,19-21H,11-16H2
InChIKey VCUUZKIQRCIOLH-UHFFFAOYSA-N
Mol Weight 339.44 g/mol
Molecular Formula C21H25NO3
Exact Mass 339.183444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LsAB0NbuhaC
Name (1rs,4rs,6rs)-9-Benzyl-4-benzyloxymethyl-9-aza-3,8-dioxabicyclo[4.3.0]nonane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 339.183443666 u
Formula C21H25NO3
InChI InChI=1S/C21H25NO3/c1-3-7-17(8-4-1)12-22-21-16-24-20(11-19(21)14-25-22)15-23-13-18-9-5-2-6-10-18/h1-10,19-21H,11-16H2
InChIKey VCUUZKIQRCIOLH-UHFFFAOYSA-N
Molecular Weight 339.435 g/mol
SMILES C12COC(CC2CON1CC=1C=CC=CC1)COCC=1C=CC=CC1