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2,2',5,5'-Tetrathia-14,14'spirobi[6.3]paracyclophane

View entire compound with spectra: 2 MS (GC)

2,2',5,5'-Tetrathia-14,14'spirobi[6.3]paracyclophane
SpectraBase Compound ID KNbnoYKZ7XE
InChI InChI=1S/C37H40S4/c1-9-33-10-2-29(1)21-37(22-30-3-11-34(12-4-30)26-39-18-17-38-25-33)23-31-5-13-35(14-6-31)27-40-19-20-41-28-36-15-7-32(24-37)8-16-36/h1-16H,17-28H2
InChIKey QWMSYTBKZXJVPW-UHFFFAOYSA-N
Mol Weight 613.0 g/mol
Molecular Formula C37H40S4
Exact Mass 612.201286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GN1R97rhjGM
Name 2,2',5,5'-Tetrathia-14,14'spirobi[6.3]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H40S4
InChI InChI=1S/C37H40S4/c1-9-33-10-2-29(1)21-37(22-30-3-11-34(12-4-30)26-39-18-17-38-25-33)23-31-5-13-35(14-6-31)27-40-19-20-41-28-36-15-7-32(24-37)8-16-36/h1-16H,17-28H2
InChIKey QWMSYTBKZXJVPW-UHFFFAOYSA-N
Molecular Weight 612.967 g/mol
SMILES c1cc2CC3(Cc4ccc(cc4)CSCCSCc1cc2)Cc1ccc(cc1)CSCCSCc1ccc(C3)cc1
SPLASH splash10-0ik9-1952113000-cf42f880f8b22ab15668
Wiley ID 1476984