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Diethyl 3,3-dimethyl-1-(p-tolyl)-3,5-dihydrocyclopenta[c]pyran-6,6(7H)-dicarboxylate
SpectraBase Compound ID 2zrBBEsRwiP
InChI InChI=1S/C23H28O5/c1-6-26-20(24)23(21(25)27-7-2)13-17-12-22(4,5)28-19(18(17)14-23)16-10-8-15(3)9-11-16/h8-12H,6-7,13-14H2,1-5H3
InChIKey DKZOEOIWRXUTAC-UHFFFAOYSA-N
Mol Weight 384.47 g/mol
Molecular Formula C23H28O5
Exact Mass 384.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7PUSBFm1Vqr
Name Diethyl 3,3-dimethyl-1-(p-tolyl)-3,5-dihydrocyclopenta[c]pyran-6,6(7H)-dicarboxylate
Appearance Pale yellow oil
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Exact Mass 384.193673997 u
Formula C23H28O5
InChI InChI=1S/C23H28O5/c1-6-26-20(24)23(21(25)27-7-2)13-17-12-22(4,5)28-19(18(17)14-23)16-10-8-15(3)9-11-16/h8-12H,6-7,13-14H2,1-5H3
InChIKey DKZOEOIWRXUTAC-UHFFFAOYSA-N
Instrument Name Finnigan SSQ or 7000 Thermo Deca XP
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503293
Molecular Weight 384.472 g/mol
Quality 68
Reported Formula C23H28O5
SMILES C(C)OC(=O)C1(CC=2C(=C(OC(C2)(C)C)C2=CC=C(C=C2)C)C1)C(=O)OCC
SPLASH splash10-014i-6900000000-144c64ba37adba4391d3
Source of Spectrum QE-21-SM10-5b (DOI: 10.1002/chem.201503293)
Wiley ID 1907273