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1,12-bis(methylthio)[2](1,5)naphthaleno[2](2,6)pyrazinophane-S,S'-dioxide
SpectraBase Compound ID 7nYzuTDmDni
InChI InChI=1S/C20H20N2O2S2/c1-25(23)18-12-17-20(22-10-9-21-17)19(26(2)24)11-16-14-6-4-3-5-13(14)7-8-15(16)18/h3-10,18-19H,11-12H2,1-2H3/t18?,19-,25?,26?/m1/s1
InChIKey UEGLAZAWWBFDBH-OQZCDBLCSA-N
Mol Weight 384.51 g/mol
Molecular Formula C20H20N2O2S2
Exact Mass 384.09662 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J8nEKbzqIFx
Name 1,12-bis(methylthio)[2](1,5)naphthaleno[2](2,6)pyrazinophane-S,S'-dioxide
CAS Registry Number 100108-64-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O2S2
InChI InChI=1S/C20H20N2O2S2/c1-25(23)18-12-17-20(22-10-9-21-17)19(26(2)24)11-16-14-6-4-3-5-13(14)7-8-15(16)18/h3-10,18-19H,11-12H2,1-2H3/t18?,19-,25?,26?/m1/s1
InChIKey UEGLAZAWWBFDBH-OQZCDBLCSA-N
Molecular Weight 384.512 g/mol
SMILES c12c(C(Cc3c([C@@](C2)(S(=O)C)[H])nccn3)S(=O)C)ccc2c1cccc2
SPLASH splash10-0a4i-0091000000-536b8eb4abab4a095f9b
Source of Spectrum K-118-4919-27
Synonyms 7,13-bis(methylsulfinyl)-7,8,13,14-tetrahydronaphtho[1',2':5,6]cycloocta[1,2-b]pyrazine
Wiley ID 1361451