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(2S,3S)-3-methoxy-2,4-dimethyl-1-pentanol
SpectraBase Compound ID GsELC1mL5hD
InChI InChI=1S/C8H18O2/c1-6(2)8(10-4)7(3)5-9/h6-9H,5H2,1-4H3/t7-,8-/m0/s1
InChIKey QTHPQSJYJDTNHK-YUMQZZPRSA-N
Mol Weight 146.23 g/mol
Molecular Formula C8H18O2
Exact Mass 146.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IWVsehG4UxS
Name (2S,3S)-3-Methoxy-2,4-dimethyl-1-pentanol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 146.130679818 u
Formula C8H18O2
InChI InChI=1S/C8H18O2/c1-6(2)8(10-4)7(3)5-9/h6-9H,5H2,1-4H3/t7-,8-/m0/s1
InChIKey QTHPQSJYJDTNHK-YUMQZZPRSA-N
Molecular Weight 146.230 g/mol
SMILES [C@]([C@](CO)(C)[H])(C(C)C)(OC)[H]