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Methyl cis-3-(1-Hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxylate
SpectraBase Compound ID HOwjWbHQQHk
InChI InChI=1S/C9H16O3/c1-5(10)6-7(8(11)12-4)9(6,2)3/h5-7,10H,1-4H3/t5?,6-,7-/m0/s1
InChIKey IMYJINPEULFLRM-BYRXKDITSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LpAcfvPhWlx
Name Methyl cis-3-(1-Hydroxyethyl)-2,2-dimethylcyclopropane-1-carboxylate
Alternate Name(s) Methyl (1R,3S)-3-[(1S)-1-hydroxyethyl]-2,2-dimethylcyclopropanecarboxylate
Comments Edited after expert review - Original record with SpectrumID 860911 removed
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Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-5(10)6-7(8(11)12-4)9(6,2)3/h5-7,10H,1-4H3/t5?,6-,7-/m0/s1
InChIKey IMYJINPEULFLRM-BYRXKDITSA-N
Molecular Weight 172.224 g/mol
SMILES OC([C@@]1(C([C@@]1(C(=O)OC)[H])(C)C)[H])C
SPLASH splash10-0035-9200000000-3f12e869ef48c66632b7
Source of Spectrum QA-31-167-5
Wiley ID 1718223