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1,3-Di-tert-butyl-5-hydroxy-5-methylcyclopenta-1,3-diene

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1,3-Di-tert-butyl-5-hydroxy-5-methylcyclopenta-1,3-diene
SpectraBase Compound ID 79hB6Hjcprd
InChI InChI=1S/C14H24O/c1-12(2,3)10-8-11(13(4,5)6)14(7,15)9-10/h8-9,15H,1-7H3
InChIKey RDOTZXAHRBBMHI-UHFFFAOYSA-N
Mol Weight 208.34 g/mol
Molecular Formula C14H24O
Exact Mass 208.182715 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H2kKTrkFB2a
Name 1,3-di-Tert-butyl-5-hydroxy-5-methylcyclopenta-1,3-diene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 208.182715392 u
Formula C14H24O
InChI InChI=1S/C14H24O/c1-12(2,3)10-8-11(13(4,5)6)14(7,15)9-10/h8-9,15H,1-7H3
InChIKey RDOTZXAHRBBMHI-UHFFFAOYSA-N
Molecular Weight 208.345 g/mol
SMILES C1(=CC(C(C)(C)C)=CC1(O)C)C(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.967119