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5-(3-Quinolinylthio)methyloxolan-2-one
SpectraBase Compound ID 535hBOTcqtg
InChI InChI=1S/C14H13NO2S/c16-14-6-5-11(17-14)9-18-12-7-10-3-1-2-4-13(10)15-8-12/h1-4,7-8,11H,5-6,9H2
InChIKey UPDCYTCFNKKCBS-UHFFFAOYSA-N
Mol Weight 259.32 g/mol
Molecular Formula C14H13NO2S
Exact Mass 259.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6vo2xGKFDFG
Name 5-(3-Quinolinylthio)methyloxolan-2-one
Alternate Name(s) 5-[(3-quinolinylsulfanyl)methyl]dihydro-2(3H)-furanone
Comments Less than 3 mono-isotopic peaks
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Formula C14H13NO2S
InChI InChI=1S/C14H13NO2S/c16-14-6-5-11(17-14)9-18-12-7-10-3-1-2-4-13(10)15-8-12/h1-4,7-8,11H,5-6,9H2
InChIKey UPDCYTCFNKKCBS-UHFFFAOYSA-N
Molecular Weight 259.323 g/mol
SMILES C1(OC(CC1)CSc1cnc2c(c1)cccc2)=O
SPLASH splash10-08fr-0890000000-1d6ea3eb2f33fd463add
Source of Spectrum O1-65-2868-8
Wiley ID 1593388