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3,3a-Epoxydicyclopenta[a,d]cyclooctan-4.beta.-ol, 9,10a-dimethyl-6-methylene-3.beta.-isopropyl-
SpectraBase Compound ID H6Bq3vnJA9M
InChI InChI=1S/C20H32O2/c1-12(2)19-9-8-18(5)11-16-13(3)6-7-15(16)14(4)10-17(21)20(18,19)22-19/h12-13,15-17,21H,4,6-11H2,1-3,5H3
InChIKey BHSIHWKKWXKBHZ-UHFFFAOYSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8HcvG9oGdYJ
Name 3,3A-Epoxydicyclopenta[A,D]cyclooctan-4.beta.-ol, 9,10A-dimethyl-6-methylene-3.beta.-isopropyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 304.240230268 u
Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-12(2)19-9-8-18(5)11-16-13(3)6-7-15(16)14(4)10-17(21)20(18,19)22-19/h12-13,15-17,21H,4,6-11H2,1-3,5H3
InChIKey BHSIHWKKWXKBHZ-UHFFFAOYSA-N
Molecular Weight 304.474 g/mol
SMILES CC1CCC2C1CC1(C)CCC3(C1(O3)C(O)CC2=C)C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928652