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2-Heptanol
SpectraBase Compound ID HP9gsGiV6U5
InChI InChI=1S/C7H16O/c1-3-4-5-6-7(2)8/h7-8H,3-6H2,1-2H3
InChIKey CETWDUZRCINIHU-UHFFFAOYSA-N
Mol Weight 116.2 g/mol
Molecular Formula C7H16O
Exact Mass 116.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fKykt5dxik
Name 2-Heptanol
Alternate Name(s) (S)-(+)-2-Heptanol 1-Methylhexanol 2-Heptanol, (S)- 2-Heptyl alcohol 2-Hydroxyheptane Amyl methyl carbinol CH3(CH2)4CHOHCH3 Heptan-2-ol Heptanol-2 Heptyl alcohol, sec- Methyl amyl carbinol n-Heptan-2-ol s-Heptyl alcohol AI3-11263 BRN 1719088 EINECS 208-844-3 FEMA NO. 3288 NSC 2220
CAS Registry Number 543-49-7
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Formula C7H16O
InChI InChI=1S/C7H16O/c1-3-4-5-6-7(2)8/h7-8H,3-6H2,1-2H3
InChIKey CETWDUZRCINIHU-UHFFFAOYSA-N
Molecular Weight 116.204 g/mol
SMILES OC(C)CCCCC
SPLASH splash10-0005-9000000000-b0739a1f950fb15b0127
Source of Spectrum Va-0-0-0
Wiley ID 741124