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(±)-2-Octanol
SpectraBase Compound ID ETHjFbDZS5F
InChI InChI=1S/C8H18O/c1-3-4-5-6-7-8(2)9/h8-9H,3-7H2,1-2H3
InChIKey SJWFXCIHNDVPSH-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 97Al3xL3mRu
Name 2-Octanol (D3)
CAS Registry Number 123-96-6
Comments Note: The molecular formula of the structure shown is C8H18O - which differs from the formula reported for the mass spectrum (C8H15D3O)
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Formula C8H15D3O
InChI InChI=1S/C8H18O/c1-3-4-5-6-7-8(2)9/h8-9H,3-7H2,1-2H3
InChIKey SJWFXCIHNDVPSH-UHFFFAOYSA-N
Molecular Weight 130.231 g/mol
SMILES OC(CCCCCC)C
SPLASH splash10-0002-9000000000-7cb0a010723ab818f7b5
Synonyms Octan-2-ol (D3) Capryl alcohol (trideuterated)
Wiley ID 1482349