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2-Chloro-10-(4'-methoxyphenoxyacetyl)phenothiazine

View entire compound with spectra: 1 NMR, and 1 FTIR

2-Chloro-10-(4'-methoxyphenoxyacetyl)phenothiazine
SpectraBase Compound ID 50ZYk3jaov6
InChI InChI=1S/C21H16ClNO3S/c1-25-15-7-9-16(10-8-15)26-13-21(24)23-17-4-2-3-5-19(17)27-20-11-6-14(22)12-18(20)23/h2-12H,13H2,1H3
InChIKey LCJHETZVDMZGEQ-UHFFFAOYSA-N
Mol Weight 397.88 g/mol
Molecular Formula C21H16ClNO3S
Exact Mass 397.053942 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LsAreKkE8Cs
Name 2-Chloro-10-(4'-methoxyphenoxyacetyl)phenothiazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 397.053942250 u
Formula C21H16ClNO3S
InChI InChI=1S/C21H16ClNO3S/c1-25-15-7-9-16(10-8-15)26-13-21(24)23-17-4-2-3-5-19(17)27-20-11-6-14(22)12-18(20)23/h2-12H,13H2,1H3
InChIKey LCJHETZVDMZGEQ-UHFFFAOYSA-N
Molecular Weight 397.876 g/mol
SMILES C1=2N(C3=C(SC2C=CC(=C1)Cl)C=CC=C3)C(COC1=CC=C(C=C1)OC)=O