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4H-3,1-Benzothiazine, 4-ethyl-2-(1-methylethyl)-

View entire compound with spectra: 1 FTIR

4H-3,1-Benzothiazine, 4-ethyl-2-(1-methylethyl)-
SpectraBase Compound ID 5StoTXHYOLy
InChI InChI=1S/C13H17NS/c1-4-12-10-7-5-6-8-11(10)14-13(15-12)9(2)3/h5-9,12H,4H2,1-3H3
InChIKey ZFNHZINZHIOBKP-UHFFFAOYSA-N
Mol Weight 219.35 g/mol
Molecular Formula C13H17NS
Exact Mass 219.108171 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4o2zD4goetW
Name 4H-3,1-Benzothiazine, 4-ethyl-2-(1-methylethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.108170725 u
Formula C13H17NS
InChI InChI=1S/C13H17NS/c1-4-12-10-7-5-6-8-11(10)14-13(15-12)9(2)3/h5-9,12H,4H2,1-3H3
InChIKey ZFNHZINZHIOBKP-UHFFFAOYSA-N
Molecular Weight 219.346 g/mol
SMILES C1=CC2=C(C=C1)C(SC(C(C)C)=N2)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.93167