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(3'aR,9'bR*)-3'a,4',5',9b-Tetrahydro-1'-methyl-5'-[(4-methylphenyl)sulfonyl]spiro[cyclopropane-1,3'(1H)-isoxazolo[4,3-c]quinoline]
SpectraBase Compound ID KEfOAeA7Zgl
InChI InChI=1S/C20H22N2O3S/c1-14-7-9-15(10-8-14)26(23,24)22-13-17-19(16-5-3-4-6-18(16)22)21(2)25-20(17)11-12-20/h3-10,17,19H,11-13H2,1-2H3/t17-,19+/m1/s1
InChIKey IBDKUZMKOQHBLK-MJGOQNOKSA-N
Mol Weight 370.47 g/mol
Molecular Formula C20H22N2O3S
Exact Mass 370.135114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7uhJdLg2Bbj
Name (3'aR,9'bR*)-3'a,4',5',9b-Tetrahydro-1'-methyl-5'-[(4-methylphenyl)sulfonyl]spiro[cyclopropane-1,3'(1H)-isoxazolo[4,3-c]quinoline]
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Formula C20H22N2O3S
InChI InChI=1S/C20H22N2O3S/c1-14-7-9-15(10-8-14)26(23,24)22-13-17-19(16-5-3-4-6-18(16)22)21(2)25-20(17)11-12-20/h3-10,17,19H,11-13H2,1-2H3/t17-,19+/m1/s1
InChIKey IBDKUZMKOQHBLK-MJGOQNOKSA-N
Molecular Weight 370.467 g/mol
SMILES c12N(S(c3ccc(cc3)C)(=O)=O)C[C@@]3([C@](c1cccc2)(N(OC31CC1)C)[H])[H]
SPLASH splash10-001l-4920000000-03aee4a2d94178c4da06
Source of Spectrum F-68-3278-34
Wiley ID 1572331