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10-Ethyl-3-chloro-7-nitro-phenothiazine

View entire compound with spectra: 1 FTIR

10-Ethyl-3-chloro-7-nitro-phenothiazine
SpectraBase Compound ID JFShsuAe9uC
InChI InChI=1S/C14H11ClN2O2S/c1-2-16-11-5-3-9(15)7-13(11)20-14-8-10(17(18)19)4-6-12(14)16/h3-8H,2H2,1H3
InChIKey KGXYGOMYOUEPMF-UHFFFAOYSA-N
Mol Weight 306.77 g/mol
Molecular Formula C14H11ClN2O2S
Exact Mass 306.022976 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 41omlmcEtUa
Name 10-Ethyl-3-chloro-7-nitro-phenothiazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 306.022976474 u
Formula C14H11ClN2O2S
InChI InChI=1S/C14H11ClN2O2S/c1-2-16-11-5-3-9(15)7-13(11)20-14-8-10(17(18)19)4-6-12(14)16/h3-8H,2H2,1H3
InChIKey KGXYGOMYOUEPMF-UHFFFAOYSA-N
Molecular Weight 306.767 g/mol
SMILES C1=C(C=C2C(=C1)N(C=1C(S2)=CC(=CC1)Cl)CC)N(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.874155