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3-METHYL-4-THIA-6-HEPTENAL

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3-METHYL-4-THIA-6-HEPTENAL
SpectraBase Compound ID LvlGuyx1cGv
InChI InChI=1S/C7H12OS/c1-3-6-9-7(2)4-5-8/h3,5,7H,1,4,6H2,2H3
InChIKey PJYLHEHRNXAXSA-UHFFFAOYSA-N
Mol Weight 144.23 g/mol
Molecular Formula C7H12OS
Exact Mass 144.060886 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 268sSbRMX2X
Name 3-METHYL-4-THIA-6-HEPTENAL
CAS Registry Number 127355-03-7
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12OS
InChI InChI=1S/C7H12OS/c1-3-6-9-7(2)4-5-8/h3,5,7H,1,4,6H2,2H3
InChIKey PJYLHEHRNXAXSA-UHFFFAOYSA-N
Literature Reference Author H.G.AURICH,M.BOUTAHAR,H.KOESTER,K.D.MOEBUS,L.RUIZ
Literature Reference Citation CHEM.BER.,123,1999(1990)
Literature Reference DOI 10.1002/cber.19901231011
Molecular Weight 144.232 g/mol
Solvent CDCl3
Source File Reference UWED10301