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10-Methyl-10H-tribenzo[b,e,g][1,4]thiazocine 5-oxide
SpectraBase Compound ID KfuU9T0FE9w
InChI InChI=1S/C19H15NOS/c1-20-16-10-4-2-8-14(16)15-9-3-6-12-18(15)22(21)19-13-7-5-11-17(19)20/h2-13H,1H3
InChIKey AXIKNBIUIARXNX-UHFFFAOYSA-N
Mol Weight 305.4 g/mol
Molecular Formula C19H15NOS
Exact Mass 305.087435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDFB1WUcOni
Name 10-Methyl-10H-tribenzo[b,e,g][1,4]thiazocine 5-oxide
Appearance White solid
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Formula C19H15NOS
InChI InChI=1S/C19H15NOS/c1-20-16-10-4-2-8-14(16)15-9-3-6-12-18(15)22(21)19-13-7-5-11-17(19)20/h2-13H,1H3
InChIKey AXIKNBIUIARXNX-UHFFFAOYSA-N
Instrument Name Finnigan SSQ Finnigan 7000
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.3c00012
Molecular Weight 305.395 g/mol
Reported Formula C19H15ONS
SMILES C=12S(C=3C(C=4C(N(C2=CC=CC1)C)=CC=CC4)=CC=CC3)=O
SPLASH splash10-0a4i-0059000000-12a179da48e70b07a100
Source of Spectrum JOC-88-SM14-3na (DOI: 10.1021/acs.joc.3c00012)
Wiley ID 1912697