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1-Ethanone, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-methyl-1H-imidazol-2-yl)thio]-
SpectraBase Compound ID BqanY0hXHrF
InChI InChI=1S/C14H14N2O3S/c1-16-5-4-15-14(16)20-9-11(17)10-2-3-12-13(8-10)19-7-6-18-12/h2-5,8H,6-7,9H2,1H3
InChIKey CXNAGUKJFXNYTN-UHFFFAOYSA-N
Mol Weight 290.34 g/mol
Molecular Formula C14H14N2O3S
Exact Mass 290.072513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0VfWddyWqy
Name 1-Ethanone, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-methyl-1H-imidazol-2-yl)thio]-
Alternate Name(s) 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-methyl-2-imidazolyl)thio]ethanone 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-methylimidazol-2-yl)sulfanylethanone 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O3S
InChI InChI=1S/C14H14N2O3S/c1-16-5-4-15-14(16)20-9-11(17)10-2-3-12-13(8-10)19-7-6-18-12/h2-5,8H,6-7,9H2,1H3
InChIKey CXNAGUKJFXNYTN-UHFFFAOYSA-N
Molecular Weight 290.337 g/mol
SMILES c1([n](ccn1)C)SCC(c1cc2OCCOc2cc1)=O
SPLASH splash10-03fr-9800000000-6dcb60e6950f0d8eb993
Source of Spectrum IY-1-4347-1
Wiley ID 1651454