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[7-(carboxymethyl)-10-methyl-10H-phenothiazin-2-yl]acetic acid
SpectraBase Compound ID 89tW6yONQ5d
InChI InChI=1S/C17H15NO4S/c1-18-12-4-2-11(9-17(21)22)7-15(12)23-14-5-3-10(6-13(14)18)8-16(19)20/h2-7H,8-9H2,1H3,(H,19,20)(H,21,22)
InChIKey VUAGUWFBEGNPHN-UHFFFAOYSA-N
Mol Weight 329.37 g/mol
Molecular Formula C17H15NO4S
Exact Mass 329.072179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ce0UXQZp1a7
Name [7-(carboxymethyl)-10-methyl-10H-phenothiazin-2-yl]acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15NO4S
InChI InChI=1S/C17H15NO4S/c1-18-12-4-2-11(9-17(21)22)7-15(12)23-14-5-3-10(6-13(14)18)8-16(19)20/h2-7H,8-9H2,1H3,(H,19,20)(H,21,22)
InChIKey VUAGUWFBEGNPHN-UHFFFAOYSA-N
Molecular Weight 329.370 g/mol
SMILES OC(Cc1ccc2c(N(c3ccc(CC(=O)O)cc3S2)C)c1)=O
SPLASH splash10-0059-0059000000-10f68cec5afbe0542845
Source of Spectrum K1-2001-3272-17
Synonyms 2-[7-(carboxymethyl)-10-methyl-2-phenothiazinyl]acetic acid 2-[7-(carboxymethyl)-10-methylphenothiazin-2-yl]acetic acid 2-[7-(2-hydroxy-2-oxoethyl)-10-methyl-phenothiazin-2-yl]ethanoic acid
Wiley ID 814199