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8-(1-Tosylpropan-2-ylidene)-1,4-dioxaspiro[4.5]decane

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

8-(1-Tosylpropan-2-ylidene)-1,4-dioxaspiro[4.5]decane
SpectraBase Compound ID KeYLhHwpbl2
InChI InChI=1S/C18H24O4S/c1-14-3-5-17(6-4-14)23(19,20)13-15(2)16-7-9-18(10-8-16)21-11-12-22-18/h3-6H,7-13H2,1-2H3
InChIKey QVYWRAIANYIJTO-UHFFFAOYSA-N
Mol Weight 336.45 g/mol
Molecular Formula C18H24O4S
Exact Mass 336.13953 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KBmxWkqYYTI
Name 8-(1-Tosylpropan-2-ylidene)-1,4-dioxaspiro[4.5]decane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.139530423 u
Formula C18H24O4S
InChI InChI=1S/C18H24O4S/c1-14-3-5-17(6-4-14)23(19,20)13-15(2)16-7-9-18(10-8-16)21-11-12-22-18/h3-6H,7-13H2,1-2H3
InChIKey QVYWRAIANYIJTO-UHFFFAOYSA-N
Molecular Weight 336.446 g/mol
SMILES C(S(C1=CC=C(C=C1)C)(=O)=O)C(=C1CCC2(CC1)OCCO2)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.851654