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[S-(S*,R*,S*)]-3,6-DIHYDRO-ALPHA-METHYL-3-OXO-2H-PYRAN-2-PROPANAL,ISOMER-#1
SpectraBase Compound ID FQnbWkeeYaI
InChI InChI=1S/C9H12O3/c1-7(6-10)5-9-8(11)3-2-4-12-9/h2-3,6-7,9H,4-5H2,1H3/t7?,9-/m1/s1
InChIKey WSFPDUBAWNVCJY-NHSZFOGYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Eod4srXEcw
Name [S-(S*,R*,S*)]-3,6-DIHYDRO-ALPHA-METHYL-3-OXO-2H-PYRAN-2-PROPANAL,ISOMER-#1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-7(6-10)5-9-8(11)3-2-4-12-9/h2-3,6-7,9H,4-5H2,1H3/t7?,9-/m1/s1
InChIKey WSFPDUBAWNVCJY-NHSZFOGYSA-N
Literature Reference Author J.HERSCOVICI,L.BOUMAIZA,K.ANTONAKIS
Literature Reference Citation J.ORG.CHEM.,57,2476(1992)
Literature Reference DOI 10.1021/jo00034a051
Molecular Weight 168.192 g/mol
Solvent CDCl3
Source File Reference UWCS1708