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Guaia-1(5),11-dien-3-yl methyl ether

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

Guaia-1(5),11-dien-3-yl methyl ether
SpectraBase Compound ID J2dxW2E8Vnv
InChI InChI=1S/C16H26O/c1-10(2)13-7-6-11(3)14-9-16(17-5)12(4)15(14)8-13/h11-13,16H,1,6-9H2,2-5H3/t11-,12+,13+,16+/m0/s1
InChIKey XODWWLLRRMISMT-VPWBDBDCSA-N
Mol Weight 234.38 g/mol
Molecular Formula C16H26O
Exact Mass 234.198365 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8W1x6W4ARg8
Name Guaia-1(5),11-dien-3-yl methyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.198365456 u
Formula C16H26O
InChI InChI=1S/C16H26O/c1-10(2)13-7-6-11(3)14-9-16(17-5)12(4)15(14)8-13/h11-13,16H,1,6-9H2,2-5H3/t11-,12+,13+,16+/m0/s1
InChIKey XODWWLLRRMISMT-VPWBDBDCSA-N
Molecular Weight 234.383 g/mol
SMILES [C@]1(CC[C@](CC=2[C@]([C@@](CC12)(OC)[H])(C)[H])(C(=C)C)[H])(C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.930259