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2-Methylpentane-1,3-diol
SpectraBase Compound ID 7gMQZfSTniU
InChI InChI=1S/C6H14O2/c1-3-6(8)5(2)4-7/h5-8H,3-4H2,1-2H3
InChIKey SPXWGAHNKXLXAP-UHFFFAOYSA-N
Mol Weight 118.18 g/mol
Molecular Formula C6H14O2
Exact Mass 118.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BQM7XtywTRk
Name 2-Methylpentane-1,3-diol
Alternate Name(s) 1,3-Pentanediol, 2-methyl- 2-Methyl-1,3-pentanediol AI3-00937
CAS Registry Number 149-31-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H14O2
InChI InChI=1S/C6H14O2/c1-3-6(8)5(2)4-7/h5-8H,3-4H2,1-2H3
InChIKey SPXWGAHNKXLXAP-UHFFFAOYSA-N
Molecular Weight 118.176 g/mol
SMILES OC(C(CO)C)CC
SPLASH splash10-052f-9000000000-689d6ddd8b6e0e041218
Source of Spectrum HE-1982-0-0
Wiley ID 1126493