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3-[(E)-1-PROPENYL]-PENTANEDIOATE

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3-[(E)-1-PROPENYL]-PENTANEDIOATE
SpectraBase Compound ID Eb0XeFciwSY
InChI InChI=1S/C8H12O4/c1-2-3-6(4-7(9)10)5-8(11)12/h2-3,6H,4-5H2,1H3,(H,9,10)(H,11,12)/b3-2+
InChIKey MZNNPGRTALKBID-NSCUHMNNSA-N
Mol Weight 172.18 g/mol
Molecular Formula C8H12O4
Exact Mass 172.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ian9AWCF4ZL
Name 3-[(E)-1-PROPENYL]-PENTANEDIOATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12O4
InChI InChI=1S/C8H12O4/c1-2-3-6(4-7(9)10)5-8(11)12/h2-3,6H,4-5H2,1H3,(H,9,10)(H,11,12)/b3-2+
InChIKey MZNNPGRTALKBID-NSCUHMNNSA-N
Literature Reference Author J.POLDY,R.PEAKALL,R.A.BARROW
Literature Reference Citation EUR.J.ORG.CHEM.,2012,5818(2012)
Literature Reference DOI 10.1002/ejoc.201200795
Molecular Weight 172.181 g/mol
Solvent CDCl3
Source File Reference UWLU83897