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2-Heptanol, 3-methyl-
SpectraBase Compound ID 6RbkBwWryFt
InChI InChI=1S/C8H18O/c1-4-5-6-7(2)8(3)9/h7-9H,4-6H2,1-3H3
InChIKey SZERMVMTUUAYML-UHFFFAOYSA-N
Mol Weight 130.23 g/mol
Molecular Formula C8H18O
Exact Mass 130.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 535yEnTQw5U
Name 2-Heptanol, 3-methyl-
CAS Registry Number 31367-46-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H18O
InChI InChI=1S/C8H18O/c1-4-5-6-7(2)8(3)9/h7-9H,4-6H2,1-3H3
InChIKey SZERMVMTUUAYML-UHFFFAOYSA-N
Molecular Weight 130.231 g/mol
SMILES OC(C(C)CCCC)C
SPLASH splash10-0005-9000000000-1f29f04fc20a3b0f5126
Source of Spectrum EP-3991-0-0
Synonyms 3-Methyl-2-heptanol 3-Methylheptan-2-ol NSC 92762
Wiley ID 1133053