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Methyl 4-hydroxy-5-nitrohexanoate
SpectraBase Compound ID KErzDRyitgr
InChI InChI=1S/C7H13NO5/c1-5(8(11)12)6(9)3-4-7(10)13-2/h5-6,9H,3-4H2,1-2H3
InChIKey JDAZZVFWZLXSNL-UHFFFAOYSA-N
Mol Weight 191.18 g/mol
Molecular Formula C7H13NO5
Exact Mass 191.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5cbEoobX4Mj
Name Methyl 4-hydroxy-5-nitrohexanoate
Alternate Name(s) 4-Hydroxy-5-nitro-hexanoic acid methyl ester Methyl 5-nitro-4-oxidanyl-hexanoate 4-Hydroxy-5-nitrohexanoic acid methyl ester
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Formula C7H13NO5
InChI InChI=1S/C7H13NO5/c1-5(8(11)12)6(9)3-4-7(10)13-2/h5-6,9H,3-4H2,1-2H3
InChIKey JDAZZVFWZLXSNL-UHFFFAOYSA-N
Molecular Weight 191.183 g/mol
SMILES OC(CCC(=O)OC)C(C)N(=O)=O
SPLASH splash10-0a4i-9200000000-488e676fb7478657db11
Source of Spectrum AJ-67-3090-5
Wiley ID 772854