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2-Thiaa[3](2,4"")-1:1',2':1",3":1"':2"':1""-quiquephenylophane
SpectraBase Compound ID ClNhhKs3Bmo
InChI InChI=1S/C32H24S/c1-2-14-31-27(8-1)22-33-21-23-16-18-24(19-17-23)28-11-3-4-12-29(28)25-9-7-10-26(20-25)30-13-5-6-15-32(30)31/h1-20H,21-22H2
InChIKey BUKVOPTXUFISOL-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C32H24S
Exact Mass 440.159872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CU4KttfkxNG
Name 2-Thiaa[3](2,4"")-1:1',2':1",3":1"':2"':1""-quiquephenylophane
Alternate Name(s) 2-Thiaa[3](2,4'''')-1:1',2':1'',3'':1''':2''':1''''-quiquephenylophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H24S
InChI InChI=1S/C32H24S/c1-2-14-31-27(8-1)22-33-21-23-16-18-24(19-17-23)28-11-3-4-12-29(28)25-9-7-10-26(20-25)30-13-5-6-15-32(30)31/h1-20H,21-22H2
InChIKey BUKVOPTXUFISOL-UHFFFAOYSA-N
Molecular Weight 440.604 g/mol
SMILES c1-2c(-c3cc(-c4c(-c5ccc(CSCc6c2cccc6)cc5)cccc4)ccc3)cccc1
SPLASH splash10-052f-0110900000-f211af48bedb5f052cfc
Source of Spectrum KC-0-898-9
Wiley ID 783537