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3,6-Dimethyl-3-heptanol

View entire compound with spectra: 3 NMR, 2 FTIR, and 2 MS (GC)

3,6-Dimethyl-3-heptanol
SpectraBase Compound ID KHTysVdkTDY
InChI InChI=1S/C9H20O/c1-5-9(4,10)7-6-8(2)3/h8,10H,5-7H2,1-4H3
InChIKey HVPGGLNDHUWMLS-UHFFFAOYSA-N
Mol Weight 144.26 g/mol
Molecular Formula C9H20O
Exact Mass 144.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FgKiol5LVo9
Name 3-Heptanol, 3,6-dimethyl-
CAS Registry Number 1573-28-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H20O
InChI InChI=1S/C9H20O/c1-5-9(4,10)7-6-8(2)3/h8,10H,5-7H2,1-4H3
InChIKey HVPGGLNDHUWMLS-UHFFFAOYSA-N
Molecular Weight 144.258 g/mol
SMILES OC(CC)(CCC(C)C)C
SPLASH splash10-00fu-9000000000-1d85b224491c9f98618f
Source of Spectrum JX-2015-6-4687
Synonyms 3,6-Dimethyl-3-heptanol 3,6-Dimethylheptan-3-ol
Wiley ID 1728921