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(4ar*,5S*,6R*,8as*)-9-Formyl-5,8,9-trimethyldecahydronaphthalen-1-spiro-2'-(1',3'-dioxolane)
SpectraBase Compound ID Dm9BURhD7Zn
InChI InChI=1S/C16H26O3/c1-12-6-8-15(3)13(14(12,2)11-17)5-4-7-16(15)18-9-10-19-16/h11-13H,4-10H2,1-3H3/t12-,13-,14+,15+/m0/s1
InChIKey XMFHIRFJOBYISD-BYNSBNAKSA-N
Mol Weight 266.38 g/mol
Molecular Formula C16H26O3
Exact Mass 266.188195 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID E69kn7amVKx
Name (4ar*,5S*,6R*,8as*)-9-Formyl-5,8,9-trimethyldecahydronaphthalen-1-spiro-2'-(1',3'-dioxolane)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 266.188194694 u
Formula C16H26O3
InChI InChI=1S/C16H26O3/c1-12-6-8-15(3)13(14(12,2)11-17)5-4-7-16(15)18-9-10-19-16/h11-13H,4-10H2,1-3H3/t12-,13-,14+,15+/m0/s1
InChIKey XMFHIRFJOBYISD-BYNSBNAKSA-N
Molecular Weight 266.381 g/mol
SMILES [C@@]12(C3(OCCO3)CCC[C@]1([C@@](C=O)(C)[C@](CC2)(C)[H])[H])C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.975572