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2,2,4-Trimethyl-4-(4-hydroxyphenyl)chroman, 2-methylpropionate
SpectraBase Compound ID Cs5H2VdxPkh
InChI InChI=1S/C22H26O3/c1-15(2)20(23)24-17-12-10-16(11-13-17)22(5)14-21(3,4)25-19-9-7-6-8-18(19)22/h6-13,15H,14H2,1-5H3
InChIKey RKSFKDQQVSDNQV-UHFFFAOYSA-N
Mol Weight 338.45 g/mol
Molecular Formula C22H26O3
Exact Mass 338.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5r9ahQ3Qgih
Name 2,2,4-Trimethyl-4-(4-hydroxyphenyl)chroman, 2-methylpropionate
Comments Computed using HOSE algorithm
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Exact Mass 338.188194694 u
Formula C22H26O3
InChI InChI=1S/C22H26O3/c1-15(2)20(23)24-17-12-10-16(11-13-17)22(5)14-21(3,4)25-19-9-7-6-8-18(19)22/h6-13,15H,14H2,1-5H3
InChIKey RKSFKDQQVSDNQV-UHFFFAOYSA-N
Molecular Weight 338.447 g/mol
SMILES C1(OC2=C(C(C1)(C)C1=CC=C(C=C1)OC(C(C)C)=O)C=CC=C2)(C)C