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benzamide, N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-3,4,5-trimethoxy-
SpectraBase Compound ID GeiRwbanHXq
InChI InChI=1S/C30H45NO5/c1-10-29(3,4)22-14-15-24(23(20-22)30(5,6)11-2)36-17-13-12-16-31-28(32)21-18-25(33-7)27(35-9)26(19-21)34-8/h14-15,18-20H,10-13,16-17H2,1-9H3,(H,31,32)
InChIKey JVCCKISMBQARDA-UHFFFAOYSA-N
Mol Weight 499.7 g/mol
Molecular Formula C30H45NO5
Exact Mass 499.329774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jgj9X9CkJ1Z
Name Benzamide, N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-3,4,5-trimethoxy-
Comments Computed using HOSE algorithm
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Exact Mass 499.329773548 u
Formula C30H45NO5
InChI InChI=1S/C30H45NO5/c1-10-29(3,4)22-14-15-24(23(20-22)30(5,6)11-2)36-17-13-12-16-31-28(32)21-18-25(33-7)27(35-9)26(19-21)34-8/h14-15,18-20H,10-13,16-17H2,1-9H3,(H,31,32)
InChIKey JVCCKISMBQARDA-UHFFFAOYSA-N
Molecular Weight 499.692 g/mol
SMILES N(C(C=1C=C(OC)C(=C(C1)OC)OC)=O)CCCCOC=1C(=CC(C(CC)(C)C)=CC1)C(CC)(C)C