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Methyl 2,4-bis(benzyloxymethoixy)-6-methylbenzoate
SpectraBase Compound ID 3SuPDvCmfl2
InChI InChI=1S/C25H26O6/c1-19-13-22(30-17-28-15-20-9-5-3-6-10-20)14-23(24(19)25(26)27-2)31-18-29-16-21-11-7-4-8-12-21/h3-14H,15-18H2,1-2H3
InChIKey KBVYRQZSWCXORM-UHFFFAOYSA-N
Mol Weight 422.48 g/mol
Molecular Formula C25H26O6
Exact Mass 422.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2HmfELcLfqj
Name Methyl 2,4-bis(benzyloxymethoixy)-6-methylbenzoate
Comments Computed using HOSE algorithm
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Exact Mass 422.172938551 u
Formula C25H26O6
InChI InChI=1S/C25H26O6/c1-19-13-22(30-17-28-15-20-9-5-3-6-10-20)14-23(24(19)25(26)27-2)31-18-29-16-21-11-7-4-8-12-21/h3-14H,15-18H2,1-2H3
InChIKey KBVYRQZSWCXORM-UHFFFAOYSA-N
Molecular Weight 422.477 g/mol
SMILES C1(=C(C=C(C=C1C)OCOCC1=CC=CC=C1)OCOCC1=CC=CC=C1)C(=O)OC