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2-octanol, nitrate (ester)
SpectraBase Compound ID GhZ63anMZcu
InChI InChI=1S/C8H17NO3/c1-3-4-5-6-7-8(2)12-9(10)11/h8H,3-7H2,1-2H3
InChIKey QCOKASLKYUXYJH-UHFFFAOYSA-N
Mol Weight 175.23 g/mol
Molecular Formula C8H17NO3
Exact Mass 175.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7jsoFxpslJ
Name 2-Octyl nitrate
Alternate Name(s) 1-Methylheptyl nitrate Nitric acid 1-methylheptyl ester Nitric acid octan-2-yl ester Octan-2-yl nitrate
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Formula C8H17NO3
InChI InChI=1S/C8H17NO3/c1-3-4-5-6-7-8(2)12-9(10)11/h8H,3-7H2,1-2H3
InChIKey QCOKASLKYUXYJH-UHFFFAOYSA-N
Molecular Weight 175.228 g/mol
SMILES C(ON(=O)=O)(CCCCCC)C
SPLASH splash10-0006-9000000000-101793469322b2578b09
Source of Spectrum AJ-70-3115-0
Wiley ID 774267