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2H-Benzo[F]oxireno[2,3-E]benzofuran-8(9H)-one, 9-[[[2-(diethylamino)ethyl]amino]methyl]octahydro-2,5A-dimethyl-
SpectraBase Compound ID IfA92TFoT0s
InChI InChI=1S/C21H36N2O3/c1-5-23(6-2)11-10-22-13-15-17-16(25-19(15)24)12-20(4)9-7-8-14(3)21(20)18(17)26-21/h14-18,22H,5-13H2,1-4H3
InChIKey USZGBQNPODHPSE-UHFFFAOYSA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H36N2O3
Exact Mass 364.272593 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BM2iP2egfuT
Name 2H-Benzo[F]oxireno[2,3-E]benzofuran-8(9H)-one, 9-[[[2-(diethylamino)ethyl]amino]methyl]octahydro-2,5A-dimethyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.272593024 u
Formula C21H36N2O3
InChI InChI=1S/C21H36N2O3/c1-5-23(6-2)11-10-22-13-15-17-16(25-19(15)24)12-20(4)9-7-8-14(3)21(20)18(17)26-21/h14-18,22H,5-13H2,1-4H3
InChIKey USZGBQNPODHPSE-UHFFFAOYSA-N
Molecular Weight 364.530 g/mol
SMILES C123C(C4C(C(=O)OC4CC1(CCCC2C)C)CNCCN(CC)CC)O3