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2-Pentenoic acid, 2-methyl-5-(2-methyl-3-methylenebicyclo[2.2.1]hept-2-yl)-, ethyl ester, [1.alpha.,2.beta.(Z),4.alpha.]-(.+-.)-

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2-Pentenoic acid, 2-methyl-5-(2-methyl-3-methylenebicyclo[2.2.1]hept-2-yl)-, ethyl ester, [1.alpha.,2.beta.(Z),4.alpha.]-(.+-.)-
SpectraBase Compound ID 3ySj4Qp7R0I
InChI InChI=1S/C17H26O2/c1-12(11-19-14(3)18)6-5-9-17(4)13(2)15-7-8-16(17)10-15/h11,15-16H,2,5-10H2,1,3-4H3/b12-11-/t15-,16+,17+/m1/s1
InChIKey MGTCSNHMLSXNRH-VYTZPUBASA-N
Mol Weight 262.39 g/mol
Molecular Formula C17H26O2
Exact Mass 262.19328 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JYGIv64cCb4
Name 2-Pentenoic acid, 2-methyl-5-(2-methyl-3-methylenebicyclo[2.2.1]hept-2-yl)-, ethyl ester, [1.alpha.,2.beta.(Z),4.alpha.]-(.+-.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.193280075 u
Formula C17H26O2
InChI InChI=1S/C17H26O2/c1-12(11-19-14(3)18)6-5-9-17(4)13(2)15-7-8-16(17)10-15/h11,15-16H,2,5-10H2,1,3-4H3/b12-11-/t15-,16+,17+/m1/s1
InChIKey MGTCSNHMLSXNRH-VYTZPUBASA-N
SMILES C1([C@@]([C@]2([H])C[C@]1(CC2)[H])(CCC\C(=C/OC(=O)C)C)C)=C