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4,5-Diacetoxy-1-methylindole
SpectraBase Compound ID 6WaLbtO3uRd
InChI InChI=1S/C13H13NO4/c1-8(15)17-12-5-4-11-10(6-7-14(11)3)13(12)18-9(2)16/h4-7H,1-3H3
InChIKey RHDOSFZQWQKWSB-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BcFHVUWeqDU
Name 4,5-Diacetoxy-1-methylindole
CAS Registry Number 123752-63-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c1-8(15)17-12-5-4-11-10(6-7-14(11)3)13(12)18-9(2)16/h4-7H,1-3H3
InChIKey RHDOSFZQWQKWSB-UHFFFAOYSA-N
Molecular Weight 247.250 g/mol
SMILES c12c(c(OC(=O)C)ccc2[n](C)cc1)OC(=O)C
SPLASH splash10-03di-0920000000-97575ff874156396e7f9
Source of Spectrum J-55-291-0
Synonyms 4-(acetyloxy)-1-methyl-1H-indol-5-yl acetate
Wiley ID 1249939