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2H-Benzo[f]oxireno[2,3-E]benzofuran-8(9H)-one, octahydro-9-[[[(2-methoxyphenyl)methyl]amino]methyl]-2,5a-dimethyl-
SpectraBase Compound ID nKzL69ZzKk
InChI InChI=1S/C23H31NO4/c1-14-7-6-10-22(2)11-18-19(20-23(14,22)28-20)16(21(25)27-18)13-24-12-15-8-4-5-9-17(15)26-3/h4-5,8-9,14,16,18-20,24H,6-7,10-13H2,1-3H3
InChIKey FOEBWTIHOHDNTR-UHFFFAOYSA-N
Mol Weight 385.5 g/mol
Molecular Formula C23H31NO4
Exact Mass 385.225308 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1KyVkvpgIkJ
Name 2H-Benzo[F]oxireno[2,3-E]benzofuran-8(9H)-one, octahydro-9-[[[(2-methoxyphenyl)methyl]amino]methyl]-2,5A-dimethyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 385.225308478 u
Formula C23H31NO4
InChI InChI=1S/C23H31NO4/c1-14-7-6-10-22(2)11-18-19(20-23(14,22)28-20)16(21(25)27-18)13-24-12-15-8-4-5-9-17(15)26-3/h4-5,8-9,14,16,18-20,24H,6-7,10-13H2,1-3H3
InChIKey FOEBWTIHOHDNTR-UHFFFAOYSA-N
Molecular Weight 385.504 g/mol
SMILES C123C(C4C(C(=O)OC4CC1(CCCC2C)C)CNCC1=CC=CC=C1OC)O3