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4-acetyl-N-(spiro[benzo[d][1,3]dioxole-2,1'-cyclohexan]-5-yl)benzamide

View entire compound with spectra: 2 NMR

4-acetyl-N-(spiro[benzo[d][1,3]dioxole-2,1'-cyclohexan]-5-yl)benzamide
SpectraBase Compound ID 2Dy8qAt2JIX
InChI InChI=1S/C21H21NO4/c1-14(23)15-5-7-16(8-6-15)20(24)22-17-9-10-18-19(13-17)26-21(25-18)11-3-2-4-12-21/h5-10,13H,2-4,11-12H2,1H3,(H,22,24)
InChIKey AAKOUIZMIAJBDT-UHFFFAOYSA-N
Mol Weight 351.4 g/mol
Molecular Formula C21H21NO4
Exact Mass 351.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LUIaLgKw9RT
Name 4-Acetyl-N-(spiro[benzo[D][1,3]dioxole-2,1'-cyclohexan]-5-yl)benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 351.147058156 u
Formula C21H21NO4
InChI InChI=1S/C21H21NO4/c1-14(23)15-5-7-16(8-6-15)20(24)22-17-9-10-18-19(13-17)26-21(25-18)11-3-2-4-12-21/h5-10,13H,2-4,11-12H2,1H3,(H,22,24)
InChIKey AAKOUIZMIAJBDT-UHFFFAOYSA-N
Molecular Weight 351.402 g/mol
SMILES N(C(C=1C=CC(C(=O)C)=CC1)=O)C=1C=C2OC3(OC2=CC1)CCCCC3