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5-(4-Methoxyphenylamino)-3-methyl-2-methylthio-1,3,4-thiadiazolium tetrafluoroborate
SpectraBase Compound ID 3T1fOI3bgpG
InChI InChI=1S/C11H14N3OS2.BF4/c1-14-11(16-3)17-10(13-14)12-8-4-6-9(15-2)7-5-8;2-1(3,4)5/h4-7H,1-3H3,(H,12,13);/q+1;-1
InChIKey KLQORYXWABWCTN-UHFFFAOYSA-N
Mol Weight 355.18 g/mol
Molecular Formula C11H14BF4N3OS2
Exact Mass 355.060747 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBWPEGIT72w
Name 5-(4-Methoxyphenylamino)-3-methyl-2-methylthio-1,3,4-thiadiazolium tetrafluoroborate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14BF4N3OS2
InChI InChI=1S/C11H14N3OS2.BF4/c1-14-11(16-3)17-10(13-14)12-8-4-6-9(15-2)7-5-8;2-1(3,4)5/h4-7H,1-3H3,(H,12,13);/q+1;-1
InChIKey KLQORYXWABWCTN-UHFFFAOYSA-N
Molecular Weight 355.177 g/mol
SMILES [B-](F)(F)(F)F.N(c1sc([n+](n1)C)SC)c1ccc(cc1)OC
SPLASH splash10-0f8a-1930000000-ad6849a03cc366b0c719
Source of Spectrum SO-0-924-7
Synonyms 5-(4-Methoxyanilino)-3-methyl-2-(methylsulfanyl)-1,3,4-thiadiazol-3-ium tetrafluoroborate
Wiley ID 1541009