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5-Formylmellein
SpectraBase Compound ID 4JHhgF4CjsZ
InChI InChI=1S/C11H10O4/c1-6-4-8-7(5-12)2-3-9(13)10(8)11(14)15-6/h2-3,5-6,13H,4H2,1H3/t6-/m1/s1
InChIKey PTNGWSBREHHWFF-ZCFIWIBFSA-N
Mol Weight 206.2 g/mol
Molecular Formula C11H10O4
Exact Mass 206.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 350AkZzAHCE
Name 5-Formylmellein
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10O4
InChI InChI=1S/C11H10O4/c1-6-4-8-7(5-12)2-3-9(13)10(8)11(14)15-6/h2-3,5-6,13H,4H2,1H3/t6-/m1/s1
InChIKey PTNGWSBREHHWFF-ZCFIWIBFSA-N
Literature Reference DOI 10.1002/jccs.200500117
Molecular Weight 206.197 g/mol
SMILES Oc1c2c(c(cc1)C=O)C[C@](OC2=O)(C)[H]
SPLASH splash10-06rf-0930000000-54bc8ce4b120c8c9b15c
Source of Spectrum QA-52-839-35
Synonyms (R)-8-hydroxy-3-methyl-1-oxoisochromane-5-carbaldehyde
Wiley ID 1796146