For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
tert-butyl 4-[2-(3,7-dimethylocta-2,6-dienyl)-1,3-dithian-2-yl]butanoate
SpectraBase Compound ID 51fyQ9cLu9F
InChI InChI=1S/C22H38O2S2/c1-18(2)10-7-11-19(3)13-15-22(25-16-9-17-26-22)14-8-12-20(23)24-21(4,5)6/h10,13H,7-9,11-12,14-17H2,1-6H3
InChIKey KMGMFZKOTCMJEH-UHFFFAOYSA-N
Mol Weight 398.7 g/mol
Molecular Formula C22H38O2S2
Exact Mass 398.231323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FPZmh8zMePu
Name tert-butyl 4-[2-(3,7-dimethylocta-2,6-dienyl)-1,3-dithian-2-yl]butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H38O2S2
InChI InChI=1S/C22H38O2S2/c1-18(2)10-7-11-19(3)13-15-22(25-16-9-17-26-22)14-8-12-20(23)24-21(4,5)6/h10,13H,7-9,11-12,14-17H2,1-6H3
InChIKey KMGMFZKOTCMJEH-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Molecular Weight 398.664 g/mol
Reported Formula C22H38O2S2
SMILES C(C1(CC=C(CCC=C(C)C)C)SCCCS1)CCC(OC(C)(C)C)=O
SPLASH splash10-0a4i-0190000000-f42426d20735aec3885a
Source of Spectrum US8299067B2
Thin-Layer Chromatography Rf = 0.42 (silica gel, hexanes/EtOAc, 9:1)
Wiley ID 1846876