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(3'aR)-N-Methyl-S-phenyl-S-[{tetrahydro-5'',5''-dimethylspiro[1,3-dioxan-2,2'-(1'H)-pentalen]-5(3'H)-ylidene}methyl]sulfoximine
SpectraBase Compound ID iMQvyorYB2
InChI InChI=1S/C21H29NO3S/c1-20(2)14-24-21(25-15-20)11-17-9-16(10-18(17)12-21)13-26(23,22-3)19-7-5-4-6-8-19/h4-8,13,17-18H,9-12,14-15H2,1-3H3
InChIKey YBXJVJNHPKXRIU-UHFFFAOYSA-N
Mol Weight 375.53 g/mol
Molecular Formula C21H29NO3S
Exact Mass 375.186815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2e9zkokxtI
Name (3'aR)-N-Methyl-S-phenyl-S-[{tetrahydro-5'',5''-dimethylspiro[1,3-dioxan-2,2'-(1'H)-pentalen]-5(3'H)-ylidene}methyl]sulfoximine
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Formula C21H29NO3S
InChI InChI=1S/C21H29NO3S/c1-20(2)14-24-21(25-15-20)11-17-9-16(10-18(17)12-21)13-26(23,22-3)19-7-5-4-6-8-19/h4-8,13,17-18H,9-12,14-15H2,1-3H3
InChIKey YBXJVJNHPKXRIU-UHFFFAOYSA-N
Molecular Weight 375.527 g/mol
SMILES C(S(=NC)(=O)c1ccccc1)=C1CC2CC3(CC2C1)OCC(CO3)(C)C
SPLASH splash10-05dl-3972000000-07979631232fd9fe619f
Source of Spectrum U1-1998-1326-6
Synonyms {[(3'aR)-5',5'-dimethyl-hexahydro-1'H-spiro[1,3-dioxane-2,2'-pentalene]-5-ylidenemethane](benzene)sulfinylidene}(methyl)amine
Wiley ID 751304