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3,4-dibutyl-2-[4-(3,4-dibutyl-2-thienyl)buta-1,3-diynyl]thiophene
SpectraBase Compound ID 36YYCrKp02v
InChI InChI=1S/C28H38S2/c1-5-9-15-23-21-29-27(25(23)17-11-7-3)19-13-14-20-28-26(18-12-8-4)24(22-30-28)16-10-6-2/h21-22H,5-12,15-18H2,1-4H3
InChIKey KDRBSFMAPJGFGY-UHFFFAOYSA-N
Mol Weight 438.7 g/mol
Molecular Formula C28H38S2
Exact Mass 438.241494 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GLri1fLPrGb
Name 3,4-dibutyl-2-[4-(3,4-dibutyl-2-thienyl)buta-1,3-diynyl]thiophene
Alternate Name(s) 3,4-dibutyl-2-[4-(3,4-dibutyl-2-thiophenyl)buta-1,3-diynyl]thiophene 3,4-dibutyl-2-[4-(3,4-dibutylthiophen-2-yl)buta-1,3-diynyl]thiophene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H38S2
InChI InChI=1S/C28H38S2/c1-5-9-15-23-21-29-27(25(23)17-11-7-3)19-13-14-20-28-26(18-12-8-4)24(22-30-28)16-10-6-2/h21-22H,5-12,15-18H2,1-4H3
InChIKey KDRBSFMAPJGFGY-UHFFFAOYSA-N
Molecular Weight 438.732 g/mol
SMILES C(#CC#Cc1c(c(cs1)CCCC)CCCC)c1c(c(cs1)CCCC)CCCC
SPLASH splash10-000i-0002900000-7332f7a4e76d9178a4d8
Source of Spectrum KC-57-3791-20
Wiley ID 1623953