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{3-(4-methoxyphenyl)-5-[(tetrahydro-2H-pyran-2-yloxy)methyl]isoxazol-4-yl}(thiophen-2-yl)methanone
SpectraBase Compound ID IPjL3TVfTaj
InChI InChI=1S/C21H21NO5S/c1-24-15-9-7-14(8-10-15)20-19(21(23)17-5-4-12-28-17)16(27-22-20)13-26-18-6-2-3-11-25-18/h4-5,7-10,12,18H,2-3,6,11,13H2,1H3
InChIKey WLZWJHBKPSRVLT-UHFFFAOYSA-N
Mol Weight 399.46 g/mol
Molecular Formula C21H21NO5S
Exact Mass 399.114044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGRaJR4LujE
Name {3-(4-methoxyphenyl)-5-[(tetrahydro-2H-pyran-2-yloxy)methyl]isoxazol-4-yl}(thiophen-2-yl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO5S
InChI InChI=1S/C21H21NO5S/c1-24-15-9-7-14(8-10-15)20-19(21(23)17-5-4-12-28-17)16(27-22-20)13-26-18-6-2-3-11-25-18/h4-5,7-10,12,18H,2-3,6,11,13H2,1H3
InChIKey WLZWJHBKPSRVLT-UHFFFAOYSA-N
Molecular Weight 399.461 g/mol
SMILES c1(c(noc1COC1OCCCC1)-c1ccc(cc1)OC)C(c1sccc1)=O
SPLASH splash10-0002-2491000000-9bcffde77858c8026758
Source of Spectrum F4-40-301-5s
Wiley ID 1670199