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Hexyl 3-(2,2'-bithien-5-yl)-propanoate

View entire compound with spectra: 1 MS (GC)

Hexyl 3-(2,2'-bithien-5-yl)-propanoate
SpectraBase Compound ID 2gieQv8I0I5
InChI InChI=1S/C17H22O2S2/c1-2-3-4-5-12-19-17(18)11-9-14-8-10-16(21-14)15-7-6-13-20-15/h6-8,10,13H,2-5,9,11-12H2,1H3
InChIKey IPGGFOFGWYNMST-UHFFFAOYSA-N
Mol Weight 322.48 g/mol
Molecular Formula C17H22O2S2
Exact Mass 322.106122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AluCR7UDaeU
Name Hexyl 3-(2,2'-bithien-5-yl)-propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O2S2
InChI InChI=1S/C17H22O2S2/c1-2-3-4-5-12-19-17(18)11-9-14-8-10-16(21-14)15-7-6-13-20-15/h6-8,10,13H,2-5,9,11-12H2,1H3
InChIKey IPGGFOFGWYNMST-UHFFFAOYSA-N
Molecular Weight 322.481 g/mol
SMILES c1(sc(CCC(=O)OCCCCCC)cc1)-c1sccc1
SPLASH splash10-00b9-0925000000-323e24624026da0b9ed5
Source of Spectrum F-65-9839-6
Wiley ID 1678747