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3-hydroxy-4-[(1R)-1,2,2-trimethyl-1-cyclopent-3-enyl]benzoic acid ethyl ester
SpectraBase Compound ID 1EUBUScL6ev
InChI InChI=1S/C17H22O3/c1-5-20-15(19)12-7-8-13(14(18)11-12)17(4)10-6-9-16(17,2)3/h6-9,11,18H,5,10H2,1-4H3/t17-/m0/s1
InChIKey IOYFDDXJEGVKAS-KRWDZBQOSA-N
Mol Weight 274.36 g/mol
Molecular Formula C17H22O3
Exact Mass 274.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D5sssaCV63W
Name 3-hydroxy-4-[(1R)-1,2,2-trimethyl-1-cyclopent-3-enyl]benzoic acid ethyl ester
Alternate Name(s) 3-hydroxy-4-[(1R)-1,2,2-trimethylcyclopent-3-en-1-yl]benzoic acid ethyl ester ethyl 3-hydroxy-4-[(1R)-1,2,2-trimethylcyclopent-3-en-1-yl]benzoate ethyl 3-oxidanyl-4-[(1R)-1,2,2-trimethylcyclopent-3-en-1-yl]benzoate
Comments Less than 3 mono-isotopic peaks
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Formula C17H22O3
InChI InChI=1S/C17H22O3/c1-5-20-15(19)12-7-8-13(14(18)11-12)17(4)10-6-9-16(17,2)3/h6-9,11,18H,5,10H2,1-4H3/t17-/m0/s1
InChIKey IOYFDDXJEGVKAS-KRWDZBQOSA-N
Molecular Weight 274.360 g/mol
SMILES Oc1c([C@]2(C(C=CC2)(C)C)C)ccc(C(=O)OCC)c1
SPLASH splash10-00b9-0090000000-953430a9e19f904fb0b0
Source of Spectrum J-64-8729-7
Wiley ID 1531583