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5-Methylthiazoline, 2-[4-methoxy-3-methylphenyl]-
SpectraBase Compound ID 6IVEQkjE9rS
InChI InChI=1S/C12H15NOS/c1-8-6-10(4-5-11(8)14-3)12-13-7-9(2)15-12/h4-6,9H,7H2,1-3H3
InChIKey VKKNMUPPMAAMTA-UHFFFAOYSA-N
Mol Weight 221.32 g/mol
Molecular Formula C12H15NOS
Exact Mass 221.087435 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Gmk6GjNYtiR
Name 5-Methylthiazoline, 2-[4-methoxy-3-methylphenyl]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 221.087435280 u
Formula C12H15NOS
InChI InChI=1S/C12H15NOS/c1-8-6-10(4-5-11(8)14-3)12-13-7-9(2)15-12/h4-6,9H,7H2,1-3H3
InChIKey VKKNMUPPMAAMTA-UHFFFAOYSA-N
Molecular Weight 221.318 g/mol
SMILES C1(=NCC(S1)C)C1=CC(=C(C=C1)OC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.932701