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2-(Prop-2-enoxymethyl)-1,4-dioxa-7,10,13,16-tetrathiacyclooctadecane

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

2-(Prop-2-enoxymethyl)-1,4-dioxa-7,10,13,16-tetrathiacyclooctadecane
SpectraBase Compound ID GTM8D2nq8zV
InChI InChI=1S/C16H30O3S4/c1-2-3-17-14-16-15-18-4-6-20-8-10-22-12-13-23-11-9-21-7-5-19-16/h2,16H,1,3-15H2
InChIKey YMERAYGUBOLSRF-UHFFFAOYSA-N
Mol Weight 398.7 g/mol
Molecular Formula C16H30O3S4
Exact Mass 398.10778 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3w2sdU1qz1Q
Name 2-(Prop-2-enoxymethyl)-1,4-dioxa-7,10,13,16-tetrathiacyclooctadecane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.107779519 u
Formula C16H30O3S4
InChI InChI=1S/C16H30O3S4/c1-2-3-17-14-16-15-18-4-6-20-8-10-22-12-13-23-11-9-21-7-5-19-16/h2,16H,1,3-15H2
InChIKey YMERAYGUBOLSRF-UHFFFAOYSA-N
Molecular Weight 398.653 g/mol
SMILES C1SCCSCCOC(COCCSCCSC1)COCC=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.845669