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6,6-Dimethyl-2-phenyl-3,4,6,7-tetrahydro-2H-benzofuran-4-one
SpectraBase Compound ID Lr6o35I95Ej
InChI InChI=1S/C16H18O2/c1-16(2)9-13(17)12-8-14(18-15(12)10-16)11-6-4-3-5-7-11/h3-7,14H,8-10H2,1-2H3
InChIKey ZPZZYPAYYAQYLJ-UHFFFAOYSA-N
Mol Weight 242.32 g/mol
Molecular Formula C16H18O2
Exact Mass 242.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Rsct3ozX3A
Name 6,6-Dimethyl-2-phenyl-3,4,6,7-tetrahydro-2H-benzofuran-4-one
Appearance Oil
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Exact Mass 242.130679818 u
Formula C16H18O2
InChI InChI=1S/C16H18O2/c1-16(2)9-13(17)12-8-14(18-15(12)10-16)11-6-4-3-5-7-11/h3-7,14H,8-10H2,1-2H3
InChIKey ZPZZYPAYYAQYLJ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.709
Molecular Weight 242.318 g/mol
Quality 313
Reported Formula C16H18O2
SMILES CC1(CC(C2=C(C1)OC(C2)C1=CC=CC=C1)=O)C
SPLASH splash10-0006-1940000000-f38fe2ec48a6b7382ba8
Source of Spectrum ARK-2003-91-10a (DOI: 10.3998/ark.5550190.0004.709)
Wiley ID 1900000