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2-Methyl-4,6-di(10H-phenothiazin-10-yl)phenol
SpectraBase Compound ID 4N07hMO8zNJ
InChI InChI=1S/C31H22N2OS2/c1-20-18-21(32-22-10-2-6-14-27(22)35-28-15-7-3-11-23(28)32)19-26(31(20)34)33-24-12-4-8-16-29(24)36-30-17-9-5-13-25(30)33/h2-19,34H,1H3
InChIKey DBRUHEXGYPAONE-UHFFFAOYSA-N
Mol Weight 502.65 g/mol
Molecular Formula C31H22N2OS2
Exact Mass 502.117356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kk47X1pWGZQ
Name 2-Methyl-4,6-di(10H-phenothiazin-10-yl)phenol
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 502.117355683 u
Formula C31H22N2OS2
InChI InChI=1S/C31H22N2OS2/c1-20-18-21(32-22-10-2-6-14-27(22)35-28-15-7-3-11-23(28)32)19-26(31(20)34)33-24-12-4-8-16-29(24)36-30-17-9-5-13-25(30)33/h2-19,34H,1H3
InChIKey DBRUHEXGYPAONE-UHFFFAOYSA-N
Instrument Name Agilent Technologies 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.202104292
Molecular Weight 502.650 g/mol
Quality 171
SMILES OC1=C(C)C=C(C=C1N1C2=CC=CC=C2SC2=CC=CC=C12)N1C2=C(SC3=C1C=CC=C3)C=CC=C2
SPLASH splash10-0udi-2220090000-ae5c07defdc3f127d6a1
Source of Spectrum QE-28-SM22-8c (DOI: 10.1002/chem.202104292)
Wiley ID 1900391