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3-(5-Methylthiophen-2-yl)-8H-[1,2,3]triazolo[5,1-a]isoindole
SpectraBase Compound ID 1IhUcWDiBfa
InChI InChI=1S/C14H11N3S/c1-9-6-7-12(18-9)13-14-11-5-3-2-4-10(11)8-17(14)16-15-13/h2-7H,8H2,1H3
InChIKey PMFHKJPSDKAXPD-UHFFFAOYSA-N
Mol Weight 253.32 g/mol
Molecular Formula C14H11N3S
Exact Mass 253.067369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cl4oqVuWcvW
Name 3-(5-Methylthiophen-2-yl)-8H-[1,2,3]triazolo[5,1-a]isoindole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11N3S
InChI InChI=1S/C14H11N3S/c1-9-6-7-12(18-9)13-14-11-5-3-2-4-10(11)8-17(14)16-15-13/h2-7H,8H2,1H3
InChIKey PMFHKJPSDKAXPD-UHFFFAOYSA-N
Molecular Weight 253.323 g/mol
SMILES c1-2[n](Cc3ccccc23)nnc1-c1ccc(s1)C
SPLASH splash10-0a4i-0970000000-784d5632412dd95c5419
Source of Spectrum JCR-39-189-2g
Wiley ID 1804143