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1,3-Diazatricyclo[3.3.1.1(3,7)]decan-6-one, 2-(1,3-benzodioxol-5-yl)-5-butyl-7-methyl-
SpectraBase Compound ID FGzEzkYyMcn
InChI InChI=1S/C20H26N2O3/c1-3-4-7-20-11-21-9-19(2,18(20)23)10-22(12-20)17(21)14-5-6-15-16(8-14)25-13-24-15/h5-6,8,17H,3-4,7,9-13H2,1-2H3/t17?,19-,20+
InChIKey HVXOIOSTLGLVLO-CTXDPNEZSA-N
Mol Weight 342.44 g/mol
Molecular Formula C20H26N2O3
Exact Mass 342.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JXrfzYM2rFZ
Name 1,3-Diazatricyclo[3.3.1.1(3,7)]decan-6-one, 2-(1,3-benzodioxol-5-yl)-5-butyl-7-methyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N2O3
InChI InChI=1S/C20H26N2O3/c1-3-4-7-20-11-21-9-19(2,18(20)23)10-22(12-20)17(21)14-5-6-15-16(8-14)25-13-24-15/h5-6,8,17H,3-4,7,9-13H2,1-2H3/t17?,19-,20+
InChIKey HVXOIOSTLGLVLO-CTXDPNEZSA-N
Molecular Weight 342.439 g/mol
SMILES c12OCOc2cc(cc1)C1N2C[C@]3(CN1C[C@](C3=O)(C2)C)CCCC
SPLASH splash10-0016-6911000000-46b5c60e0b868da84ca0
Source of Spectrum IY-2-4985-0
Synonyms 2-(2H-1,3-benzodioxol-5-yl)-5-butyl-7-methyl-1,3-diazatricyclo[3.3.1.1(3,7)]decan-6-one
Wiley ID 1657833