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(2RS,3SR,4RS)-4-(N-ACETYL-N-BENZYLAMINO)-2-ETHOXY-3,4-DIHYDRO-3-METHYL-2H-PYRAN-5-CARBONITRILE
SpectraBase Compound ID 33aBVq9JH4x
InChI InChI=1S/C18H22N2O3/c1-4-22-18-13(2)17(16(10-19)12-23-18)20(14(3)21)11-15-8-6-5-7-9-15/h5-9,12-13,17-18H,4,11H2,1-3H3/t13-,17-,18-/m0/s1
InChIKey IRISJUBFJNPHAI-KKXDTOCCSA-N
Mol Weight 314.39 g/mol
Molecular Formula C18H22N2O3
Exact Mass 314.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CtlkadWuA89
Name (2RS,3SR,4RS)-4-(N-ACETYL-N-BENZYLAMINO)-2-ETHOXY-3,4-DIHYDRO-3-METHYL-2H-PYRAN-5-CARBONITRILE
Compound Number 5 E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22N2O3
InChI InChI=1S/C18H22N2O3/c1-4-22-18-13(2)17(16(10-19)12-23-18)20(14(3)21)11-15-8-6-5-7-9-15/h5-9,12-13,17-18H,4,11H2,1-3H3/t13-,17-,18-/m0/s1
InChIKey IRISJUBFJNPHAI-KKXDTOCCSA-N
Literature Reference Author A.PALASZ,K.BOGDANOWICZ-SZWED
Literature Reference Citation MH.CHEM.,139,647(2008)
Literature Reference DOI 10.1007/s00706-007-0824-x
Molecular Weight 314.384 g/mol
Sample ID 39749
Solvent CDCl3