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N-[SPIRO-(2H-BENZO-[B]-PYRANO-2,1'-CYCLOHEPTAN-5-YL)]-MALONAMIDE
SpectraBase Compound ID KiUu4zd3gOX
InChI InChI=1S/C18H21NO4/c20-16(12-17(21)22)19-14-6-5-7-15-13(14)8-11-18(23-15)9-3-1-2-4-10-18/h5-8,11H,1-4,9-10,12H2,(H,19,20)(H,21,22)
InChIKey UMUQRHOXXSIAFL-UHFFFAOYSA-N
Mol Weight 315.37 g/mol
Molecular Formula C18H21NO4
Exact Mass 315.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Cngwqu1lTk
Name N-[SPIRO-(2H-BENZO-[B]-PYRANO-2,1'-CYCLOHEPTAN-5-YL)]-MALONAMIDE
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H21NO4
InChI InChI=1S/C18H21NO4/c20-16(12-17(21)22)19-14-6-5-7-15-13(14)8-11-18(23-15)9-3-1-2-4-10-18/h5-8,11H,1-4,9-10,12H2,(H,19,20)(H,21,22)
InChIKey UMUQRHOXXSIAFL-UHFFFAOYSA-N
Literature Reference Author V.PANTELEON,I.K.KOSTAKIS,P.MARAKOS,N.POULI,I.ANDREADOU
Literature Reference Citation CHEM.PHARM.BULL.,57,446(2009)
Literature Reference DOI 10.1248/cpb.57.446
Molecular Weight 315.369 g/mol
Sample ID 2415
Solvent DMSO-D6