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N,N,4-trimethylbenzothioamide
SpectraBase Compound ID Jm2xvLduyt5
InChI InChI=1S/C10H13NS/c1-8-4-6-9(7-5-8)10(12)11(2)3/h4-7H,1-3H3
InChIKey WZADGDPHGLPABW-UHFFFAOYSA-N
Mol Weight 179.28 g/mol
Molecular Formula C10H13NS
Exact Mass 179.076871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JYpFOt0Cx0f
Name N,N,4-Trimethylbenzothioamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 179.076870597 u
Formula C10H13NS
InChI InChI=1S/C10H13NS/c1-8-4-6-9(7-5-8)10(12)11(2)3/h4-7H,1-3H3
InChIKey WZADGDPHGLPABW-UHFFFAOYSA-N
Molecular Weight 179.281 g/mol
SMILES C1=CC(=CC=C1C)C(=S)N(C)C