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3-Hydroxy-3-(10-butyl-10H-phenothiazin-3-yl)propanoic acid

View entire compound with spectra: 1 MS (GC)

3-Hydroxy-3-(10-butyl-10H-phenothiazin-3-yl)propanoic acid
SpectraBase Compound ID 4466xXUgZs9
InChI InChI=1S/C19H21NO3S/c1-2-3-10-20-14-6-4-5-7-17(14)24-18-11-13(8-9-15(18)20)16(21)12-19(22)23/h4-9,11,16,21H,2-3,10,12H2,1H3,(H,22,23)
InChIKey IJLRQFMPXPDNNF-UHFFFAOYSA-N
Mol Weight 343.44 g/mol
Molecular Formula C19H21NO3S
Exact Mass 343.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bwm36Fx6O
Name 3-Hydroxy-3-(10-butyl-10H-phenothiazin-3-yl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO3S
InChI InChI=1S/C19H21NO3S/c1-2-3-10-20-14-6-4-5-7-17(14)24-18-11-13(8-9-15(18)20)16(21)12-19(22)23/h4-9,11,16,21H,2-3,10,12H2,1H3,(H,22,23)
InChIKey IJLRQFMPXPDNNF-UHFFFAOYSA-N
Molecular Weight 343.441 g/mol
SMILES OC(CC(c1ccc2c(c1)Sc1c(N2CCCC)cccc1)O)=O
SPLASH splash10-00w9-0094000000-e85e9c5dcf65b00538b4
Source of Spectrum QC-21-371-3d
Wiley ID 1688144