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2,6-Phenanthrenediol, 7-methyl-1-(methylthio)-
SpectraBase Compound ID 7b48Zvyx6jN
InChI InChI=1S/C16H14O2S/c1-9-7-10-3-4-12-11(13(10)8-15(9)18)5-6-14(17)16(12)19-2/h3-8,17-18H,1-2H3
InChIKey JBKKFLUYCPHLQF-UHFFFAOYSA-N
Mol Weight 270.35 g/mol
Molecular Formula C16H14O2S
Exact Mass 270.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DiAghqAKXqu
Name 2,6-Phenanthrenediol, 7-methyl-1-(methylthio)-
Alternate Name(s) 7-Methyl-1-(methylsulfanyl)-2,6-phenanthrenediol 7-Methyl-1-methylthiophenanthrene-2,6-diol Micrandrol C
CAS Registry Number 54278-84-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14O2S
InChI InChI=1S/C16H14O2S/c1-9-7-10-3-4-12-11(13(10)8-15(9)18)5-6-14(17)16(12)19-2/h3-8,17-18H,1-2H3
InChIKey JBKKFLUYCPHLQF-UHFFFAOYSA-N
Molecular Weight 270.346 g/mol
SMILES Oc1cc2c3ccc(c(c3ccc2cc1C)SC)O
SPLASH splash10-00di-0190000000-079a7a9bc85a3a2c0158
Source of Spectrum KC-1990-1715-16
Wiley ID 1274292