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2,4-Dithia-6,8-diazabicyclo[3.2.2]nonane-7,9-dione, 3-(4-methoxyphenyl)-6,8-dimethyl-
SpectraBase Compound ID AhKcwNXPU7l
InChI InChI=1S/C14H16N2O3S2/c1-15-10(17)13-16(2)11(18)12(15)20-14(21-13)8-4-6-9(19-3)7-5-8/h4-7,12-14H,1-3H3/t12-,13-/m1/s1
InChIKey XLNBEIIESKRQBP-CHWSQXEVSA-N
Mol Weight 324.41 g/mol
Molecular Formula C14H16N2O3S2
Exact Mass 324.060235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLC6jvC2wTl
Name 2,4-Dithia-6,8-diazabicyclo[3.2.2]nonane-7,9-dione, 3-(4-methoxyphenyl)-6,8-dimethyl-
CAS Registry Number 49593-01-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2O3S2
InChI InChI=1S/C14H16N2O3S2/c1-15-10(17)13-16(2)11(18)12(15)20-14(21-13)8-4-6-9(19-3)7-5-8/h4-7,12-14H,1-3H3/t12-,13-/m1/s1
InChIKey XLNBEIIESKRQBP-CHWSQXEVSA-N
Molecular Weight 324.413 g/mol
SMILES [C@]12(N(C(=O)[C@](N(C2=O)C)(SC(S1)c1ccc(cc1)OC)[H])C)[H]
SPLASH splash10-0006-0900000000-75b4d3a64637d825d123
Source of Spectrum F-37-2069-0
Synonyms 3-(4-Methoxyphenyl)-6,8-dimethyl-2,4-dithia-6,8-diazabicyclo[3.2.2]nonane-7,9-dione p-anisaldehyde thioacetal 3-(4-Methoxyphenyl)-7,9-dimethyl-2,4-dithia-7,9-diazabicyclo[3.2.2]nonane-6,8-dione
Wiley ID 1322874