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(2aR*,8bR*)-2a,3,4,8b-Tetrahydro-1-methyl-4-[(4-methylphenyl)sulfonyl]azeto[3,2-c]quinolin-2(1H)-one]
SpectraBase Compound ID BXRFaomOOfB
InChI InChI=1S/C18H18N2O3S/c1-12-7-9-13(10-8-12)24(22,23)20-11-15-17(19(2)18(15)21)14-5-3-4-6-16(14)20/h3-10,15,17H,11H2,1-2H3/t15-,17+/m1/s1
InChIKey VRPSUGCAOPAOFU-WBVHZDCISA-N
Mol Weight 342.41 g/mol
Molecular Formula C18H18N2O3S
Exact Mass 342.103814 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3DGR3fuZfAu
Name (2aR*,8bR*)-2a,3,4,8b-Tetrahydro-1-methyl-4-[(4-methylphenyl)sulfonyl]azeto[3,2-c]quinolin-2(1H)-one]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2O3S
InChI InChI=1S/C18H18N2O3S/c1-12-7-9-13(10-8-12)24(22,23)20-11-15-17(19(2)18(15)21)14-5-3-4-6-16(14)20/h3-10,15,17H,11H2,1-2H3/t15-,17+/m1/s1
InChIKey VRPSUGCAOPAOFU-WBVHZDCISA-N
Molecular Weight 342.413 g/mol
SMILES c12N(S(c3ccc(cc3)C)(=O)=O)C[C@@]3([C@](c1cccc2)(N(C3=O)C)[H])[H]
SPLASH splash10-001i-9500000000-0f304cb5d85c2db97569
Source of Spectrum F-68-3278-42
Wiley ID 1572327