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(1R,2R,7R)-2,6-Dimethybicyclo[5.3.0]dec-5-en-2-ol
SpectraBase Compound ID 1vvLLJTC3zg
InChI InChI=1S/C12H20O/c1-9-5-4-8-12(2,13)11-7-3-6-10(9)11/h5,10-11,13H,3-4,6-8H2,1-2H3/t10-,11+,12+/m0/s1
InChIKey OVYUTTUIMXUBQG-QJPTWQEYSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CjTdTqI8JmN
Name (1R,2R,7R)-2,6-Dimethybicyclo[5.3.0]dec-5-en-2-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 180.151415263 u
Formula C12H20O
InChI InChI=1S/C12H20O/c1-9-5-4-8-12(2,13)11-7-3-6-10(9)11/h5,10-11,13H,3-4,6-8H2,1-2H3/t10-,11+,12+/m0/s1
InChIKey OVYUTTUIMXUBQG-QJPTWQEYSA-N
Molecular Weight 180.291 g/mol
SMILES [C@@]12([C@]([C@](O)(CCC=C2C)C)(CCC1)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.965719