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.omega.-[5-(2-Furyl)-1,3,4-oxadiazol-2-thiolacetoxy]-.omega.-(1H-1,2,4-triazol-1-yl)acetophenone
SpectraBase Compound ID BwatzjyERAB
InChI InChI=1S/C18H13N5O5S/c24-14(9-29-18-22-21-16(28-18)13-7-4-8-26-13)27-17(23-11-19-10-20-23)15(25)12-5-2-1-3-6-12/h1-8,10-11,17H,9H2
InChIKey PACKJHHJYRUHRL-UHFFFAOYSA-N
Mol Weight 411.39 g/mol
Molecular Formula C18H13N5O5S
Exact Mass 411.06374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NMIvlvtk9A
Name .omega.-[5-(2-Furyl)-1,3,4-oxadiazol-2-thiolacetoxy]-.omega.-(1H-1,2,4-triazol-1-yl)acetophenone
Alternate Name(s) 2-Oxo-2-phenyl-1-(1H-1,2,4-triazol-1-yl)ethyl {[5-(2-furyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13N5O5S
InChI InChI=1S/C18H13N5O5S/c24-14(9-29-18-22-21-16(28-18)13-7-4-8-26-13)27-17(23-11-19-10-20-23)15(25)12-5-2-1-3-6-12/h1-8,10-11,17H,9H2
InChIKey PACKJHHJYRUHRL-UHFFFAOYSA-N
Molecular Weight 411.392 g/mol
SMILES c1(oc(SCC(OC([n]2ncnc2)C(=O)c2ccccc2)=O)nn1)-c1occc1
SPLASH splash10-0a4i-2960000000-67f59323ee8c5a51ec18
Source of Spectrum QA-46-232-5
Wiley ID 863157