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(E)-Dimethyl 3-(2-cyclohexylethylidene)-4-methylenecyclopentane-1,1-dicarboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(E)-Dimethyl 3-(2-cyclohexylethylidene)-4-methylenecyclopentane-1,1-dicarboxylate
SpectraBase Compound ID LPgk505sA6Q
InChI InChI=1S/C18H26O4/c1-13-11-18(16(19)21-2,17(20)22-3)12-15(13)10-9-14-7-5-4-6-8-14/h10,14H,1,4-9,11-12H2,2-3H3/b15-10+
InChIKey BEEPOFONDSDCOM-XNTDXEJSSA-N
Mol Weight 306.4 g/mol
Molecular Formula C18H26O4
Exact Mass 306.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11K7PCIvBQK
Name (E)-Dimethyl 3-(2-cyclohexylethylidene)-4-methylenecyclopentane-1,1-dicarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 306.183109313 u
Formula C18H26O4
InChI InChI=1S/C18H26O4/c1-13-11-18(16(19)21-2,17(20)22-3)12-15(13)10-9-14-7-5-4-6-8-14/h10,14H,1,4-9,11-12H2,2-3H3/b15-10+
InChIKey BEEPOFONDSDCOM-XNTDXEJSSA-N
Molecular Weight 306.402 g/mol
SMILES C1(C\C(=C/CC2CCCCC2)C(C1)=C)(C(=O)OC)C(=O)OC