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2-[4-Acetylamino-2,3-dimethyl-2(E)-butenyl)-1,3-dithiacyclohexane

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2-[4-Acetylamino-2,3-dimethyl-2(E)-butenyl)-1,3-dithiacyclohexane
SpectraBase Compound ID D22GLaiXJHb
InChI InChI=1S/C12H21NOS2/c1-9(10(2)8-13-11(3)14)7-12-15-5-4-6-16-12/h12H,4-8H2,1-3H3,(H,13,14)/b10-9+
InChIKey VSAKBOYUTLZQLV-MDZDMXLPSA-N
Mol Weight 259.43 g/mol
Molecular Formula C12H21NOS2
Exact Mass 259.106457 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3dPghRNv6Mq
Name 2-[4-Acetylamino-2,3-dimethyl-2(E)-butenyl)-1,3-dithiacyclohexane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 259.106456647 u
Formula C12H21NOS2
InChI InChI=1S/C12H21NOS2/c1-9(10(2)8-13-11(3)14)7-12-15-5-4-6-16-12/h12H,4-8H2,1-3H3,(H,13,14)/b10-9+
InChIKey VSAKBOYUTLZQLV-MDZDMXLPSA-N
SMILES C(\C(=C\(CC1SCCCS1)C)C)NC(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934282