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N-(1)-[(3AS,4R,7S,7AS)-2,2,7-TRIMETHYL-3A,4,7,7A-TETRAHYDRO-1,3-BENZODIOXOL-4-YL]-BENZAMIDE
SpectraBase Compound ID GgALdgzRqkd
InChI InChI=1S/C17H21NO4/c1-16(2)21-13-12(9-10-17(3,20)14(13)22-16)18-15(19)11-7-5-4-6-8-11/h4-10,12-14,20H,1-3H3,(H,18,19)/t12-,13+,14+,17+/m1/s1
InChIKey JNGCYRJAPCQYOC-FHIRATQRSA-N
Mol Weight 303.36 g/mol
Molecular Formula C17H21NO4
Exact Mass 303.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JZ35B9mmm1F
Name N-(1)-[(3AS,4R,7S,7AS)-2,2,7-TRIMETHYL-3A,4,7,7A-TETRAHYDRO-1,3-BENZODIOXOL-4-YL]-BENZAMIDE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H21NO4
InChI InChI=1S/C17H21NO4/c1-16(2)21-13-12(9-10-17(3,20)14(13)22-16)18-15(19)11-7-5-4-6-8-11/h4-10,12-14,20H,1-3H3,(H,18,19)/t12-,13+,14+,17+/m1/s1
InChIKey JNGCYRJAPCQYOC-FHIRATQRSA-N
Literature Reference Author B.J.M.AULEY,M.NIEUWENHUYZEN,G.N.SHELDRAKE
Literature Reference Citation ORG.LETTERS,2,1457(2000)
Literature Reference DOI 10.1021/ol000057q
Molecular Weight 303.358 g/mol
Solvent CDCl3
Source File Reference UWSI25816