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5-Isopropyl-6,6-dimethyl-hept-3-ene-2,5-diol

View entire compound with spectra: 1 FTIR, and 3 MS (GC)

5-Isopropyl-6,6-dimethyl-hept-3-ene-2,5-diol
SpectraBase Compound ID BggqBuBWjMB
InChI InChI=1S/C12H24O2/c1-9(2)12(14,11(4,5)6)8-7-10(3)13/h7-10,13-14H,1-6H3/b8-7+
InChIKey CAYHOJPWXZGMRX-BQYQJAHWSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BjS9bUpuSIK
Name 5-Isopropyl-6,6-dimethyl-hept-3-ene-2,5-diol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 200.177630011 u
Formula C12H24O2
InChI InChI=1S/C12H24O2/c1-9(2)12(14,11(4,5)6)8-7-10(3)13/h7-10,13-14H,1-6H3/b8-7+
InChIKey CAYHOJPWXZGMRX-BQYQJAHWSA-N
Molecular Weight 200.322 g/mol
SMILES CC(C)C(\C=C\C(C)O)(O)C(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.964119