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Dimethyl 3,7-diethyltricyclo[3.3.0.0(3,7)]octane-1,5-dicarboxylate
SpectraBase Compound ID 85VXViPgYfg
InChI InChI=1S/C16H24O4/c1-5-13-7-15(11(17)19-3)9-14(13,6-2)10-16(15,8-13)12(18)20-4/h5-10H2,1-4H3/t13-,14+,15-,16+
InChIKey GNQOVFBZVPPKBR-GEEKYZPCSA-N
Mol Weight 280.36 g/mol
Molecular Formula C16H24O4
Exact Mass 280.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 60apWKQnnFC
Name Dimethyl 3,7-diethyltricyclo[3.3.0.0(3,7)]octane-1,5-dicarboxylate
Appearance Orange oil
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Formula C16H24O4
InChI InChI=1S/C16H24O4/c1-5-13-7-15(11(17)19-3)9-14(13,6-2)10-16(15,8-13)12(18)20-4/h5-10H2,1-4H3/t13-,14+,15-,16+
InChIKey GNQOVFBZVPPKBR-GEEKYZPCSA-N
Instrument Name Agilent 5975 GC-122-5532 DB-5MS
Ionization Type EI
Literature Reference DOI 10.1021/jm401340p
Molecular Weight 280.364 g/mol
Reported Formula C16H24O4
SMILES [C@]12(C[C@]3([C@](C[C@@]2(C3)CC)(C1)C(OC)=O)C(=O)OC)CC
SPLASH splash10-022d-1920000000-09a92a1a0e2a16fadd96
Source of Spectrum AF-56-SM7-22c
Wiley ID 1865449