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1-[5-(5-thiophen-2-yl-2-thiophenyl)-2-thiophenyl]-1-heptadecanol
SpectraBase Compound ID JshNBXhCnXC
InChI InChI=1S/C29H42OS3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-24(30)25-19-20-28(32-25)29-22-21-27(33-29)26-18-16-23-31-26/h16,18-24,30H,2-15,17H2,1H3
InChIKey QGLVWZFLFRTDMN-UHFFFAOYSA-N
Mol Weight 502.8 g/mol
Molecular Formula C29H42OS3
Exact Mass 502.239779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9td6QTEHPHm
Name 1-[5-(5-thiophen-2-yl-2-thiophenyl)-2-thiophenyl]-1-heptadecanol
Alternate Name(s) 1-[5-[5-(2-thienyl)-2-thienyl]-2-thienyl]heptadecan-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H42OS3
InChI InChI=1S/C29H42OS3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-24(30)25-19-20-28(32-25)29-22-21-27(33-29)26-18-16-23-31-26/h16,18-24,30H,2-15,17H2,1H3
InChIKey QGLVWZFLFRTDMN-UHFFFAOYSA-N
Molecular Weight 502.834 g/mol
SMILES OC(c1sc(-c2sc(-c3sccc3)cc2)cc1)CCCCCCCCCCCCCCCC
SPLASH splash10-0019-0070900000-094e2065243460fca7fb
Source of Spectrum F-51-2236-9
Wiley ID 791053