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ethyl 4-(2-oxo-2-{4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.0(2,6)]dodecan-8-yl}ethyl)benzoate
SpectraBase Compound ID 2miBsBBQU4z
InChI InChI=1S/C21H27NO8/c1-6-25-18(24)11-7-9-12(10-8-11)22-17(23)15-13-14(28-20(2,3)27-13)16-19(26-15)30-21(4,5)29-16/h7-10,13-16,19H,6H2,1-5H3,(H,22,23)
InChIKey NMMJQMRQMYERHR-UHFFFAOYSA-N
Mol Weight 421.45 g/mol
Molecular Formula C21H27NO8
Exact Mass 421.173667 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gc77pHfNSn2
Name ethyl 4-(2-oxo-2-{4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.0(2,6)]dodecan-8-yl}ethyl)benzoate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 421.173666825 u
Formula C21H27NO8
InChI InChI=1S/C21H27NO8/c1-6-25-18(24)11-7-9-12(10-8-11)22-17(23)15-13-14(28-20(2,3)27-13)16-19(26-15)30-21(4,5)29-16/h7-10,13-16,19H,6H2,1-5H3,(H,22,23)
InChIKey NMMJQMRQMYERHR-UHFFFAOYSA-N
Molecular Weight 421.446 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5047
Solvent DMSO-d6
Source Vendor ID: NMR/13289131