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2-(6-iodanyl-1,3-benzodioxol-5-yl)-1-(3,4,5-trimethoxyphenyl)ethanone
SpectraBase Compound ID 1yXfFgbf8r5
InChI InChI=1S/C18H17IO6/c1-21-16-6-11(7-17(22-2)18(16)23-3)13(20)4-10-5-14-15(8-12(10)19)25-9-24-14/h5-8H,4,9H2,1-3H3
InChIKey QUXFOOWYLGLYBO-UHFFFAOYSA-N
Mol Weight 456.23 g/mol
Molecular Formula C18H17IO6
Exact Mass 456.006983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dk5G74DXtwc
Name 2-(6-iodanyl-1,3-benzodioxol-5-yl)-1-(3,4,5-trimethoxyphenyl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17IO6
InChI InChI=1S/C18H17IO6/c1-21-16-6-11(7-17(22-2)18(16)23-3)13(20)4-10-5-14-15(8-12(10)19)25-9-24-14/h5-8H,4,9H2,1-3H3
InChIKey QUXFOOWYLGLYBO-UHFFFAOYSA-N
Molecular Weight 456.232 g/mol
SMILES c1(c(cc(cc1OC)C(Cc1c(cc2c(c1)OCO2)I)=O)OC)OC
SPLASH splash10-002b-0941000000-a11ee4d2e98e491a7644
Source of Spectrum J-60-592-19
Synonyms 2-(6-iodo-1,3-benzodioxol-5-yl)-1-(3,4,5-trimethoxyphenyl)ethanone
Wiley ID 1389166