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2,5-bis(Thiocyanato)-pyrrole
SpectraBase Compound ID GiYq0tjeTL0
InChI InChI=1S/C6H3N3S2/c7-3-10-5-1-2-6(9-5)11-4-8/h1-2,9H
InChIKey XNHLBUWAADESPF-UHFFFAOYSA-N
Mol Weight 181.23 g/mol
Molecular Formula C6H3N3S2
Exact Mass 180.976839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1umTShIY3Q5
Name 2,5-bis(Thiocyanato)-pyrrole
Alternate Name(s) 5-(cyanosulfanyl)-1H-pyrrol-2-yl thiocyanate (5-thiocyanato-1H-pyrrol-2-yl) thiocyanate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H3N3S2
InChI InChI=1S/C6H3N3S2/c7-3-10-5-1-2-6(9-5)11-4-8/h1-2,9H
InChIKey XNHLBUWAADESPF-UHFFFAOYSA-N
Molecular Weight 181.231 g/mol
SMILES [nH]1c(ccc1SC#N)SC#N
SPLASH splash10-0feb-3900000000-d98b9f391bfcbf2538b5
Source of Spectrum I-85-936-2
Wiley ID 1584926