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1'',3''-dihydro-1'',1'',2,2,3'',3'',4,4-octamethyldispiro[cyclopentane-1,2'-thiirane-3',2''-[2H]-indene]
SpectraBase Compound ID 56FP9n9Z3R7
InChI InChI=1S/C22H32S/c1-17(2)13-18(3,4)21(14-17)22(23-21)19(5,6)15-11-9-10-12-16(15)20(22,7)8/h9-12H,13-14H2,1-8H3
InChIKey LWNBKFDSCQOEFF-UHFFFAOYSA-N
Mol Weight 328.6 g/mol
Molecular Formula C22H32S
Exact Mass 328.222472 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID NWjFf3MxXO
Name 1'',3''-Dihydro-1'',1'',2,2,3'',3'',4,4-octamethyldispiro[cyclopentane-1,2'-thiirane-3',2''-[2H]-indene]
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 328.222472204 u
Formula C22H32S
InChI InChI=1S/C22H32S/c1-17(2)13-18(3,4)21(14-17)22(23-21)19(5,6)15-11-9-10-12-16(15)20(22,7)8/h9-12H,13-14H2,1-8H3
InChIKey LWNBKFDSCQOEFF-UHFFFAOYSA-N
Molecular Weight 328.558 g/mol
SMILES C12(C3(C(CC(C3)(C)C)(C)C)S1)C(C1=CC=CC=C1C2(C)C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.886526