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4a(2H)-Naphthalenemethanol, 1-(1,3-dioxolan-2-yl)octahydro-4-hydroxy-1,2-dimethyl-5-methylene-, (1.alpha.,2.beta.,4.beta.,4a.beta.,8a.alp ha.)-(.+-.)-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

4a(2H)-Naphthalenemethanol, 1-(1,3-dioxolan-2-yl)octahydro-4-hydroxy-1,2-dimethyl-5-methylene-, (1.alpha.,2.beta.,4.beta.,4a.beta.,8a.alp ha.)-(.+-.)-
SpectraBase Compound ID Jwxq6ht2usn
InChI InChI=1S/C17H28O4/c1-11-5-4-6-13-16(3,15-20-7-8-21-15)12(2)9-14(19)17(11,13)10-18/h12-15,18-19H,1,4-10H2,2-3H3/t12-,13-,14+,16+,17+/m1/s1
InChIKey XUHLRRTURBFEKN-BJMQQELFSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EIpVzKjgwRU
Name 4A(2H)-Naphthalenemethanol, 1-(1,3-dioxolan-2-yl)octahydro-4-hydroxy-1,2-dimethyl-5-methylene-, (1.alpha.,2.beta.,4.beta.,4A.beta.,8A.alp ha.)-(.+-.)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.198759378 u
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-11-5-4-6-13-16(3,15-20-7-8-21-15)12(2)9-14(19)17(11,13)10-18/h12-15,18-19H,1,4-10H2,2-3H3/t12-,13-,14+,16+,17+/m1/s1
InChIKey XUHLRRTURBFEKN-BJMQQELFSA-N
Molecular Weight 296.407 g/mol
SMILES [C@@]12([C@@]([C@](C3OCCO3)(C)[C@@](C[C@@]1(O)[H])(C)[H])(CCCC2=C)[H])CO
Spectrum/Structure Validation Score (Vapor Phase IR) 0.945111