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3-Methyl-1,5-pentanediol
SpectraBase Compound ID AfRbFyoEY26
InChI InChI=1S/C6H14O2/c1-6(2-4-7)3-5-8/h6-8H,2-5H2,1H3
InChIKey SXFJDZNJHVPHPH-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 L3DLQUxYLRl
Name 1,5-Pentanediol, 3-methyl-
CAS Registry Number 4457-71-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H14O2
InChI InChI=1S/C6H14O2/c1-6(2-4-7)3-5-8/h6-8H,2-5H2,1H3
InChIKey SXFJDZNJHVPHPH-UHFFFAOYSA-N
Molecular Weight 118.176 g/mol
SMILES OCCC(CCO)C
SPLASH splash10-05mo-9000000000-cc4839583c938993df8f
Source of Spectrum NP-0-4889-0
Synonyms 1,5-Dihydroxy-3-methylpentane 3-Methyl-1,5-pentanediol 3-Methylpentane-1,5-diol AI3-28481 BRN 1697331 EINECS 224-709-1 NSC 6496
Wiley ID 1096052