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Tetrahydro-2,4,6-trimethyl-1,3,4-thiadiazine-2-acetic acid ethyl ester
SpectraBase Compound ID IbONsPCjxOX
InChI InChI=1S/C10H20N2O2S/c1-5-14-9(13)6-10(3)11-12(4)7-8(2)15-10/h8,11H,5-7H2,1-4H3
InChIKey MKQKYJHUCXLSOH-UHFFFAOYSA-N
Mol Weight 232.34 g/mol
Molecular Formula C10H20N2O2S
Exact Mass 232.124549 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EGoTpDFxgyV
Name Tetrahydro-2,4,6-trimethyl-1,3,4-thiadiazine-2-acetic acid ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.124549064 u
Formula C10H20N2O2S
InChI InChI=1S/C10H20N2O2S/c1-5-14-9(13)6-10(3)11-12(4)7-8(2)15-10/h8,11H,5-7H2,1-4H3
InChIKey MKQKYJHUCXLSOH-UHFFFAOYSA-N
Molecular Weight 232.342 g/mol
SMILES CC1CN(C)NC(S1)(C)CC(=O)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.83331