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5-Methyl-2-(propan-2-yl)-4-(10H-phenothiazin-10-yl)phenol
SpectraBase Compound ID LqPX5XvqLvX
InChI InChI=1S/C22H21NOS/c1-14(2)16-13-19(15(3)12-20(16)24)23-17-8-4-6-10-21(17)25-22-11-7-5-9-18(22)23/h4-14,24H,1-3H3
InChIKey CADWMEHMSBSPNQ-UHFFFAOYSA-N
Mol Weight 347.48 g/mol
Molecular Formula C22H21NOS
Exact Mass 347.134385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1sxxWTlxEli
Name 5-Methyl-2-(propan-2-yl)-4-(10H-phenothiazin-10-yl)phenol
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 347.134385473 u
Formula C22H21NOS
InChI InChI=1S/C22H21NOS/c1-14(2)16-13-19(15(3)12-20(16)24)23-17-8-4-6-10-21(17)25-22-11-7-5-9-18(22)23/h4-14,24H,1-3H3
InChIKey CADWMEHMSBSPNQ-UHFFFAOYSA-N
Instrument Name Agilent Technologies 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.202104292
Molecular Weight 347.476 g/mol
Quality 12
SMILES OC1=C(C=C(C(C)=C1)N1C2=C(SC3=C1C=CC=C3)C=CC=C2)C(C)C
SPLASH splash10-0002-0309000000-dc2f46cd1db8b0f37607
Source of Spectrum QE-28-SM16-7g (DOI: 10.1002/chem.202104292)
Wiley ID 1900381