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(1R,5S)-Ethyl 1-Isopropyl-4-methylenespiro[4.5]dec-7-ene-8-carboxylate
SpectraBase Compound ID E5dKzR5GcC8
InChI InChI=1S/C17H26O2/c1-5-19-16(18)14-8-10-17(11-9-14)13(4)6-7-15(17)12(2)3/h8,12,15H,4-7,9-11H2,1-3H3/t15-,17+/m1/s1
InChIKey VQAZLZSPMKEOSH-WBVHZDCISA-N
Mol Weight 262.39 g/mol
Molecular Formula C17H26O2
Exact Mass 262.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DXTp72EMIbF
Name (1R,5S)-Ethyl 1-Isopropyl-4-methylenespiro[4.5]dec-7-ene-8-carboxylate
Appearance Yellowish oil
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Formula C17H26O2
InChI InChI=1S/C17H26O2/c1-5-19-16(18)14-8-10-17(11-9-14)13(4)6-7-15(17)12(2)3/h8,12,15H,4-7,9-11H2,1-3H3/t15-,17+/m1/s1
InChIKey VQAZLZSPMKEOSH-WBVHZDCISA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c02627
Molecular Weight 262.393 g/mol
Optical Rotation [a]D25 = +46.4 (c = 1.00, CDCl3)
Reported Formula C17H26O2
SMILES [C@@]12(C(CC[C@@]2(C(C)C)[H])=C)CCC(=CC1)C(OCC)=O
SPLASH splash10-014j-5940000000-276a016da764f805df55
Source of Spectrum JOC-87-649-18
Wiley ID 1884193