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(3aS,7R,7aS)-7,7a-Dihydro-7-hydroxy-2,2-dimethyl-1,3-benzodioxol-4(3aH)-one, 0.2 g/mL, in 0.1M
SpectraBase Compound ID 2LifvRTaWGQ
InChI InChI=1S/C9H12O4/c1-9(2)12-7-5(10)3-4-6(11)8(7)13-9/h3-5,7-8,10H,1-2H3/t5-,7+,8-/m1/s1
InChIKey HGCFQLJTJYOOEV-MHSYXAOVSA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1WN7xzzCvPu
Name (3aS,7R,7aS)-7,7a-Dihydro-7-hydroxy-2,2-dimethyl-1,3-benzodioxol-4(3aH)-one, 0.2 g/mL, in 0.1M
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 493880
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-9(2)12-7-5(10)3-4-6(11)8(7)13-9/h3-5,7-8,10H,1-2H3/t5-,7+,8-/m1/s1
InChIKey HGCFQLJTJYOOEV-MHSYXAOVSA-N
Molecular Weight 184.191 g/mol
Observed nucleus 1H
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_014739