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(+-)-cis-N-Benzyl-6a-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-oxa-3-azabicyclo[3.3.0]octane
SpectraBase Compound ID 761xLLHW55H
InChI InChI=1S/C22H23NO3/c1-2-5-18(6-3-1)14-23-15-26-22(11-4-7-21(22)23)12-10-17-8-9-19-20(13-17)25-16-24-19/h1-3,5-6,8-10,12-13,21H,4,7,11,14-16H2/b12-10+/t21-,22-/m0/s1
InChIKey WYDZRISXSRQEAL-KJMXETMRSA-N
Mol Weight 349.43 g/mol
Molecular Formula C22H23NO3
Exact Mass 349.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXxPnywxA1K
Name (+-)-cis-N-Benzyl-6a-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-oxa-3-azabicyclo[3.3.0]octane
Alternate Name(s) (+-)-cis-N-Benzyl-8-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-oxa-3-azabicyclo[3.3.0]octane (3aS,6aS)-6a-((E)-2-Benzo[1,3]dioxol-5-yl-vinyl)-3-benzyl-hexahydro-cyclopentaoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO3
InChI InChI=1S/C22H23NO3/c1-2-5-18(6-3-1)14-23-15-26-22(11-4-7-21(22)23)12-10-17-8-9-19-20(13-17)25-16-24-19/h1-3,5-6,8-10,12-13,21H,4,7,11,14-16H2/b12-10+/t21-,22-/m0/s1
InChIKey WYDZRISXSRQEAL-KJMXETMRSA-N
Molecular Weight 349.430 g/mol
SMILES C1N([C@@]2([C@](O1)(CCC2)\C=C\c1cc2OCOc2cc1)[H])Cc1ccccc1
SPLASH splash10-0006-9036000000-aad7ec3930a57ffca446
Source of Spectrum J-58-4668-23
Wiley ID 1341498