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N-(1,3,4-thiadiazol-2-yl)-4-aminocoumarin
SpectraBase Compound ID 8f4fQRMtJ7k
InChI InChI=1S/C11H7N3O2S/c15-10-5-8(13-11-14-12-6-17-11)7-3-1-2-4-9(7)16-10/h1-6H,(H,13,14)
InChIKey OCJILMMOUJJQSX-UHFFFAOYSA-N
Mol Weight 245.26 g/mol
Molecular Formula C11H7N3O2S
Exact Mass 245.025898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CHyX79qRoml
Name N-(1,3,4-thiadiazol-2-yl)-4-aminocoumarin
Appearance Solid
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Exact Mass 245.025897649 u
Formula C11H7N3O2S
InChI InChI=1S/C11H7N3O2S/c15-10-5-8(13-11-14-12-6-17-11)7-3-1-2-4-9(7)16-10/h1-6H,(H,13,14)
InChIKey OCJILMMOUJJQSX-UHFFFAOYSA-N
Instrument Name AEI MS 902 S
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0002.610
Molecular Weight 245.256 g/mol
Quality 629
SMILES N(C1=CC(OC2=C1C=CC=C2)=O)C1=NN=CS1
SPLASH splash10-00xr-4930000000-0ac16b1344f8d9aa94ef
Source of Spectrum ARK-2001-106-8b (DOI: 10.3998/ark.5550190.0002.610)
Wiley ID 1908785