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1,3-Butanediol, 2-methyl-
SpectraBase Compound ID 4h6IbhFkYme
InChI InChI=1S/C5H12O2/c1-4(3-6)5(2)7/h4-7H,3H2,1-2H3
InChIKey GNBPEYCZELNJMS-UHFFFAOYSA-N
Mol Weight 104.15 g/mol
Molecular Formula C5H12O2
Exact Mass 104.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yF9Ov5PVJ1
Name 1,3-Butanediol, 2-methyl-
Alternate Name(s) 2-Methyl-1,3-butanediol 2-Methylbutane-1,3-diol 2-Methylbutanediol-1,3 BRN 1732163
CAS Registry Number 684-84-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H12O2
InChI InChI=1S/C5H12O2/c1-4(3-6)5(2)7/h4-7H,3H2,1-2H3
InChIKey GNBPEYCZELNJMS-UHFFFAOYSA-N
Molecular Weight 104.149 g/mol
SMILES OCC(C(C)O)C
SPLASH splash10-0005-9000000000-a0eea542a0003a0ce7f9
Source of Spectrum AA-0-306-4
Wiley ID 2114