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2,2,4,4,6-Pentamethyldispiro[bicyclo[4.3.0]non-1(9)-ene-3,1',5,1''-biscycllobutane
SpectraBase Compound ID Lr4SjJmcBZl
InChI InChI=1S/C20H32/c1-16(2)15-9-6-10-18(15,5)20(13-8-14-20)17(3,4)19(16)11-7-12-19/h9H,6-8,10-14H2,1-5H3
InChIKey RVSZYYWXRUROHV-UHFFFAOYSA-N
Mol Weight 272.5 g/mol
Molecular Formula C20H32
Exact Mass 272.250401 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FYxdanhRJ1o
Name 2,2,4,4,6-Pentamethyldispiro[bicyclo[4.3.0]non-1(9)-ene-3,1',5,1''-biscycllobutane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 272.250401030 u
Formula C20H32
InChI InChI=1S/C20H32/c1-16(2)15-9-6-10-18(15,5)20(13-8-14-20)17(3,4)19(16)11-7-12-19/h9H,6-8,10-14H2,1-5H3
InChIKey RVSZYYWXRUROHV-UHFFFAOYSA-N
Molecular Weight 272.476 g/mol
SMILES C=12C(C3(C(C)(C)C4(C2(C)C)CCC4)CCC3)(CCC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.93261