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2-(ethylthio)-9H-pyrimido[4,5-b]indole
SpectraBase Compound ID GopN7H4QPl3
InChI InChI=1S/C12H11N3S/c1-2-16-12-13-7-9-8-5-3-4-6-10(8)14-11(9)15-12/h3-7H,2H2,1H3,(H,13,14,15)
InChIKey DTSADMUSYRSEFX-UHFFFAOYSA-N
Mol Weight 229.3 g/mol
Molecular Formula C12H11N3S
Exact Mass 229.067369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9lETQECkS
Name 2-(ethylthio)-9H-pyrimido[4,5-b]indole
Alternate Name(s) 2-(ethylthio)-9H-pyrimid[4,5-b]indole 2-Ethylsulfanyl-9H-pyrimido[4,5-b]indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N3S
InChI InChI=1S/C12H11N3S/c1-2-16-12-13-7-9-8-5-3-4-6-10(8)14-11(9)15-12/h3-7H,2H2,1H3,(H,13,14,15)
InChIKey DTSADMUSYRSEFX-UHFFFAOYSA-N
Molecular Weight 229.301 g/mol
SMILES N1C(=NC=C2C1=Nc1ccccc21)SCC
SPLASH splash10-00g1-0930000000-b9689d88e49d529ce2ef
Source of Spectrum O1-35-1066-7
Wiley ID 819542