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[(Z)-3-methyl-5-(5-methyl-2-thienyl)pent-2-enyl] acetate
SpectraBase Compound ID CaPNAFMxgqt
InChI InChI=1S/C13H18O2S/c1-10(8-9-15-12(3)14)4-6-13-7-5-11(2)16-13/h5,7-8H,4,6,9H2,1-3H3/b10-8-
InChIKey PLUWEKWLJKMNRS-NTMALXAHSA-N
Mol Weight 238.34 g/mol
Molecular Formula C13H18O2S
Exact Mass 238.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ITJkklLVs4u
Name [(Z)-3-methyl-5-(5-methyl-2-thienyl)pent-2-enyl] acetate
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 238.102750992 u
Formula C13H18O2S
InChI InChI=1S/C13H18O2S/c1-10(8-9-15-12(3)14)4-6-13-7-5-11(2)16-13/h5,7-8H,4,6,9H2,1-3H3/b10-8-
InChIKey PLUWEKWLJKMNRS-NTMALXAHSA-N
Instrument Name Thermo DSQ II
Ionization Type EI
Literature Reference DOI 10.1002/jsfa.3696
Molecular Weight 238.345 g/mol
Number of Peaks 10
SMILES C(\C=C/(CCc1ccc(s1)C)C)OC(=O)C
SPLASH splash10-03fr-2900000000-fa8c6abccba507b7afee
Source of Spectrum SFA-89-2092-Acetate 5Z (DOI: 10.1002/jsfa.3696)
Wiley ID 1840274