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5-Thiazolethiol, 4,5-dihydro-4,4-dimethyl-2-phenyl-5-(2-propenyl)-
SpectraBase Compound ID AnjSGmKIuQP
InChI InChI=1S/C14H17NS2/c1-4-10-14(16)13(2,3)15-12(17-14)11-8-6-5-7-9-11/h4-9,16H,1,10H2,2-3H3
InChIKey PFRPKGGZXXADAL-UHFFFAOYSA-N
Mol Weight 263.42 g/mol
Molecular Formula C14H17NS2
Exact Mass 263.080242 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BT4Kw2hWhlq
Name 5-Thiazolethiol, 4,5-dihydro-4,4-dimethyl-2-phenyl-5-(2-propenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 263.080241899 u
Formula C14H17NS2
InChI InChI=1S/C14H17NS2/c1-4-10-14(16)13(2,3)15-12(17-14)11-8-6-5-7-9-11/h4-9,16H,1,10H2,2-3H3
InChIKey PFRPKGGZXXADAL-UHFFFAOYSA-N
SMILES C=1(SC(C(N1)(C)C)(S)CC=C)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.906829