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4(15)-Selinene-11,12-diol, dimethyl ether
SpectraBase Compound ID CRkldJwqKbB
InChI InChI=1S/C17H30O2/c1-13-7-6-9-16(2)10-8-14(11-15(13)16)17(3,19-5)12-18-4/h14-15H,1,6-12H2,2-5H3/t14-,15+,16-,17?/m1/s1
InChIKey CPAZUDMFLFGING-LVYZTWJOSA-N
Mol Weight 266.42 g/mol
Molecular Formula C17H30O2
Exact Mass 266.22458 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8yjPGtArVaw
Name 4(15)-Selinene-11,12-diol, dimethyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 266.224580204 u
Formula C17H30O2
InChI InChI=1S/C17H30O2/c1-13-7-6-9-16(2)10-8-14(11-15(13)16)17(3,19-5)12-18-4/h14-15H,1,6-12H2,2-5H3/t14-,15+,16-,17?/m1/s1
InChIKey CPAZUDMFLFGING-LVYZTWJOSA-N
Molecular Weight 266.425 g/mol
SMILES C(C(C)(OC)[C@]1(C[C@]2([H])[C@@](CC1)(CCCC2=C)C)[H])OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.931235