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3-Methyl-2-(4-methylbenzenesulfoxy)-4,5-methylenedioxybenzaldehyde
SpectraBase Compound ID JFA8qGTbQnw
InChI InChI=1S/C16H14O6S/c1-10-3-5-13(6-4-10)23(18,19)22-15-11(2)16-14(20-9-21-16)7-12(15)8-17/h3-8H,9H2,1-2H3
InChIKey ABQOQHGFXPJBMV-UHFFFAOYSA-N
Mol Weight 334.34 g/mol
Molecular Formula C16H14O6S
Exact Mass 334.051109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dtfh1awBO
Name 3-Methyl-2-(4-methylbenzenesulfoxy)-4,5-methylenedioxybenzaldehyde
Alternate Name(s) (6-formyl-4-methyl-1,3-benzodioxol-5-yl) 4-methylbenzenesulfonate (6-methanoyl-4-methyl-1,3-benzodioxol-5-yl) 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14O6S
InChI InChI=1S/C16H14O6S/c1-10-3-5-13(6-4-10)23(18,19)22-15-11(2)16-14(20-9-21-16)7-12(15)8-17/h3-8H,9H2,1-2H3
InChIKey ABQOQHGFXPJBMV-UHFFFAOYSA-N
Molecular Weight 334.342 g/mol
SMILES c1(OS(c2ccc(cc2)C)(=O)=O)c(c2OCOc2cc1C=O)C
SPLASH splash10-0059-1903000000-e9446b1e292143bfb347
Source of Spectrum E2-51-825-8
Wiley ID 1556204