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12d-Methyl-4b,8b,12b-tris(propylsulfanyl)-4b,8b,12b,12d-tetrahydrodibenzo[2,3:4,5]pentaleno[1,6-ab]indene
SpectraBase Compound ID 59ksTuEIzDV
InChI InChI=1S/C32H36S3/c1-5-20-33-30-23-14-8-10-16-25(23)31(34-21-6-2)27-18-12-13-19-28(27)32(29(30,31)4,35-22-7-3)26-17-11-9-15-24(26)30/h8-19H,5-7,20-22H2,1-4H3/t29-,30-,31+,32-
InChIKey ICDVFLNVQYTFFQ-BWEICFOXSA-N
Mol Weight 516.8 g/mol
Molecular Formula C32H36S3
Exact Mass 516.197915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 74quScg2GzN
Name 12d-Methyl-4b,8b,12b-tris(propylsulfanyl)-4b,8b,12b,12d-tetrahydrodibenzo[2,3:4,5]pentaleno[1,6-ab]indene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H36S3
InChI InChI=1S/C32H36S3/c1-5-20-33-30-23-14-8-10-16-25(23)31(34-21-6-2)27-18-12-13-19-28(27)32(29(30,31)4,35-22-7-3)26-17-11-9-15-24(26)30/h8-19H,5-7,20-22H2,1-4H3/t29-,30-,31+,32-
InChIKey ICDVFLNVQYTFFQ-BWEICFOXSA-N
Molecular Weight 516.820 g/mol
SMILES C12([C@]3(c4ccccc4[C@@]2(c2ccccc2[C@@]1(c1ccccc31)SCCC)SCCC)SCCC)C
SPLASH splash10-0006-0223900000-d57d48608f877bbf7ad7
Source of Spectrum KC-57-3606-46
Wiley ID 1623913