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N(A)-ACETYL-17-BETA-WIELAND-GUMLICH-ALDEHYDE
SpectraBase Compound ID I9q9at02bEb
InChI InChI=1S/C21H24N2O3/c1-12(24)23-16-5-3-2-4-15(16)21-7-8-22-11-13-6-9-26-20(25)18(19(21)23)14(13)10-17(21)22/h2-6,14,17-20,25H,7-11H2,1H3/t14-,17-,18+,19-,20-,21+/m0/s1
InChIKey QSDMAJZSSDNJPO-RNEOQEHVSA-N
Mol Weight 352.43 g/mol
Molecular Formula C21H24N2O3
Exact Mass 352.178693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FPECJfKu4s9
Name N(A)-ACETYL-17-BETA-WIELAND-GUMLICH-ALDEHYDE
CAS Registry Number 509-40-0
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24N2O3
InChI InChI=1S/C21H24N2O3/c1-12(24)23-16-5-3-2-4-15(16)21-7-8-22-11-13-6-9-26-20(25)18(19(21)23)14(13)10-17(21)22/h2-6,14,17-20,25H,7-11H2,1H3/t14-,17-,18+,19-,20-,21+/m0/s1
InChIKey QSDMAJZSSDNJPO-RNEOQEHVSA-N
Literature Reference Author E.WENKERT,H.T.A.CHEUNG,H.E.GOTTLIEB,M.C.KOCH,A.RABARON,M.M.P LAT
Literature Reference Citation J.ORG.CHEM.,43,1099(1978)
Literature Reference DOI 10.1021/jo00400a017
Molecular Weight 352.433 g/mol
Solvent CD3OD:CH3OH:NH3=1:2:1
Source File Reference UWRK2431