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PROBUCOL-SECONDARY PRODUCT 2
SpectraBase Compound ID DjGMKx5hzP5
InChI InChI=1S/C28H42O2S/c1-25(2,3)19-13-17(14-20(23(19)29)26(4,5)6)31-18-15-21(27(7,8)9)24(30)22(16-18)28(10,11)12/h13-16,29-30H,1-12H3
InChIKey DQSYGNJXYMAPMV-UHFFFAOYSA-N
Mol Weight 442.7 g/mol
Molecular Formula C28H42O2S
Exact Mass 442.290552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AlblB1Of5UB
Name PROBUCOL-SECONDARY PRODUCT 2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H42O2S
InChI InChI=1S/C28H42O2S/c1-25(2,3)19-13-17(14-20(23(19)29)26(4,5)6)31-18-15-21(27(7,8)9)24(30)22(16-18)28(10,11)12/h13-16,29-30H,1-12H3
InChIKey DQSYGNJXYMAPMV-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 442.702 g/mol
SMILES Oc1c(cc(Sc2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)cc1C(C)(C)C)C(C)(C)C
SPLASH splash10-052f-3940400000-25165e2058894ad53c99
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany