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5-tert-Butylthio-6-nitroquinoline

View entire compound with spectra: 1 MS (GC)

5-tert-Butylthio-6-nitroquinoline
SpectraBase Compound ID E7A0iPA6Gtz
InChI InChI=1S/C13H14N2O2S/c1-13(2,3)18-12-9-5-4-8-14-10(9)6-7-11(12)15(16)17/h4-8H,1-3H3
InChIKey UBKUZHSALOGPRP-UHFFFAOYSA-N
Mol Weight 262.33 g/mol
Molecular Formula C13H14N2O2S
Exact Mass 262.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1gwnWAXr9C
Name 5-tert-Butylthio-6-nitroquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O2S
InChI InChI=1S/C13H14N2O2S/c1-13(2,3)18-12-9-5-4-8-14-10(9)6-7-11(12)15(16)17/h4-8H,1-3H3
InChIKey UBKUZHSALOGPRP-UHFFFAOYSA-N
Molecular Weight 262.327 g/mol
SMILES c1(c(c2cccnc2cc1)SC(C)(C)C)N(=O)=O
SPLASH splash10-052f-0940000000-567ea8ee59772bec5730
Source of Spectrum KC-0-3642-2
Synonyms 5-(tert-butylsulfanyl)-6-nitroquinoline tert-Butyl 6-nitro-5-quinolinyl sulfide 5-(tert-butylthio)-6-nitroquinoline 5-tert-Butylsulfanyl-6-nitroquinoline 5-tert-Butylsulfanyl-6-nitro-quinoline
Wiley ID 831908