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(4S,8aS)-3-butyl-4-phenyl-6,7,8,8a-tetrahydro-4H-isoxazolo[3,4-a]-pyrrolizine
SpectraBase Compound ID AqLnLuvV1Fz
InChI InChI=1S/C18H22N2O/c1-2-3-11-15-16-17(19-21-15)14-10-7-12-20(14)18(16)13-8-5-4-6-9-13/h4-6,8-9,14,18H,2-3,7,10-12H2,1H3/t14-,18-/m0/s1
InChIKey XZTLTVRAJNWGCB-KSSFIOAISA-N
Mol Weight 282.39 g/mol
Molecular Formula C18H22N2O
Exact Mass 282.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1L1GhzeUh5c
Name (4S,8aS)-3-butyl-4-phenyl-6,7,8,8a-tetrahydro-4H-isoxazolo[3,4-a]-pyrrolizine
Alternate Name(s) (4S,8aS)-3-butyl-4-phenyl-6,7,8,8a-tetrahydro-4H-isoxazolo[3,4-a]pyrrolizine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22N2O
InChI InChI=1S/C18H22N2O/c1-2-3-11-15-16-17(19-21-15)14-10-7-12-20(14)18(16)13-8-5-4-6-9-13/h4-6,8-9,14,18H,2-3,7,10-12H2,1H3/t14-,18-/m0/s1
InChIKey XZTLTVRAJNWGCB-KSSFIOAISA-N
Literature Reference DOI 10.1002/ajoc.201600223
Molecular Weight 282.387 g/mol
SMILES C1N2[C@@](CC1)(c1c([C@@]2(c2ccccc2)[H])c(on1)CCCC)[H]
SPLASH splash10-0a6r-7980000000-09cf9b2c400df7061283
Source of Spectrum AJO-5-1024-7k
Wiley ID 1798880