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2-({4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.0²,⁶]dodecan-8-yl}formamido)acetic acid
SpectraBase Compound ID 9o4WuSkBPrr
InChI InChI=1S/C14H21NO8/c1-13(2)20-7-8(21-13)10-12(23-14(3,4)22-10)19-9(7)11(18)15-5-6(16)17/h7-10,12H,5H2,1-4H3,(H,15,18)(H,16,17)
InChIKey GGSFFXKXAVNAID-UHFFFAOYSA-N
Mol Weight 331.32 g/mol
Molecular Formula C14H21NO8
Exact Mass 331.126717 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BJP9FNLU4Rl
Name 2-({4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.0²,⁶]dodecan-8-yl}formamido)acetic acid
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 331.126716632 u
Formula C14H21NO8
InChI InChI=1S/C14H21NO8/c1-13(2)20-7-8(21-13)10-12(23-14(3,4)22-10)19-9(7)11(18)15-5-6(16)17/h7-10,12H,5H2,1-4H3,(H,15,18)(H,16,17)
InChIKey GGSFFXKXAVNAID-UHFFFAOYSA-N
Molecular Weight 331.321 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5042
Solvent DMSO-d6
Source Vendor ID: NMR/13289124