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4-Butyloctane-2,4-diol
SpectraBase Compound ID Aoytsh0cmtI
InChI InChI=1S/C12H26O2/c1-4-6-8-12(14,9-7-5-2)10-11(3)13/h11,13-14H,4-10H2,1-3H3
InChIKey NXYNNUOWSFTLTO-UHFFFAOYSA-N
Mol Weight 202.34 g/mol
Molecular Formula C12H26O2
Exact Mass 202.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vluQSH4ipr
Name 4-Butyloctane-2,4-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H26O2
InChI InChI=1S/C12H26O2/c1-4-6-8-12(14,9-7-5-2)10-11(3)13/h11,13-14H,4-10H2,1-3H3
InChIKey NXYNNUOWSFTLTO-UHFFFAOYSA-N
Molecular Weight 202.338 g/mol
SMILES OC(CC(C)O)(CCCC)CCCC
SPLASH splash10-052f-9200000000-8e339440f341919dcccc
Source of Spectrum F-52-13748-6
Wiley ID 799326