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Cyclic form of 3,3'-bis{2"-(Propylthio)-3"-[(3"',4"'-dihydroisoxazolyl]-5"-methylthiophene}
SpectraBase Compound ID FP2bDAEqzyY
InChI InChI=1S/C22H26N2O2S4/c1-13-9-17-19-11-15(25-23-19)6-4-8-28-22-18(10-14(2)30-22)20-12-16(26-24-20)5-3-7-27-21(17)29-13/h9-10,15-16H,3-8,11-12H2,1-2H3
InChIKey VZODNUYXZLLKMO-UHFFFAOYSA-N
Mol Weight 478.7 g/mol
Molecular Formula C22H26N2O2S4
Exact Mass 478.087713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66xY5tYP9w3
Name Cyclic form of 3,3'-bis{2"-(Propylthio)-3"-[(3"',4"'-dihydroisoxazolyl]-5"-methylthiophene}
Alternate Name(s) 3,3'-bis{2''-(Propylthio)-3''-[(4''',5'''-dihydro-isoxazolyl]-5''-methylthiophene}
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N2O2S4
InChI InChI=1S/C22H26N2O2S4/c1-13-9-17-19-11-15(25-23-19)6-4-8-28-22-18(10-14(2)30-22)20-12-16(26-24-20)5-3-7-27-21(17)29-13/h9-10,15-16H,3-8,11-12H2,1-2H3
InChIKey VZODNUYXZLLKMO-UHFFFAOYSA-N
Molecular Weight 478.702 g/mol
SMILES c12c(sc(c2)C)SCCCC2ON=C(C2)c2c(SCCCC3CC1=NO3)sc(C)c2
SPLASH splash10-014i-0941400000-4dae50081483aec1691a
Source of Spectrum QF-42-1207-3
Wiley ID 833094