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(1R*,2S*,10S*)-1,6-dimethyl-10-ethoxy-bicyclo[5.3.0]dec-6-en-2-ol
SpectraBase Compound ID BUJfBsyYLn
InChI InChI=1S/C14H24O2/c1-4-16-13-9-8-11-10(2)6-5-7-12(15)14(11,13)3/h12-13,15H,4-9H2,1-3H3/t12-,13-,14+/m0/s1
InChIKey LTBWYZJBNSCITN-MELADBBJSA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3VovcHIDEnO
Name (1R*,2S*,10S*)-1,6-Dimethyl-10-ethoxy-bicyclo[5.3.0]dec-6-en-2-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 224.177630011 u
Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-4-16-13-9-8-11-10(2)6-5-7-12(15)14(11,13)3/h12-13,15H,4-9H2,1-3H3/t12-,13-,14+/m0/s1
InChIKey LTBWYZJBNSCITN-MELADBBJSA-N
Molecular Weight 224.344 g/mol
SMILES [C@@]12(C(=C(CCC[C@@]2(O)[H])C)CC[C@@]1(OCC)[H])C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.942584