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[2](1,4)Naphthaleno[2](2,6)pyridinophane, 1,12-bis(methylthio)-
SpectraBase Compound ID HIUQ91iHC16
InChI InChI=1S/C21H21NS2/c1-23-20-12-14-10-11-15(17-7-4-3-6-16(14)17)13-21(24-2)19-9-5-8-18(20)22-19/h3-11,20-21H,12-13H2,1-2H3
InChIKey AEKBTKURCHOAQP-UHFFFAOYSA-N
Mol Weight 351.53 g/mol
Molecular Formula C21H21NS2
Exact Mass 351.111542 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JYK11x2t3MM
Name [2](1,4)Naphthaleno[2](2,6)pyridinophane, 1,12-bis(methylthio)-
CAS Registry Number 99745-98-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NS2
InChI InChI=1S/C21H21NS2/c1-23-20-12-14-10-11-15(17-7-4-3-6-16(14)17)13-21(24-2)19-9-5-8-18(20)22-19/h3-11,20-21H,12-13H2,1-2H3
InChIKey AEKBTKURCHOAQP-UHFFFAOYSA-N
Molecular Weight 351.526 g/mol
SMILES CSC1Cc2c3c(c(CC(c4cccc1n4)SC)cc2)cccc3
SPLASH splash10-0zfr-1987000000-39febdae9713be5406d6
Source of Spectrum HE-1982-0-0
Wiley ID 1342700