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6-(N-Butyl)oxy-2,5,7,8-tetramethylchroman-2-carboxylic acid, N-butyl ester

View entire compound with spectra: 1 NMR

6-(N-Butyl)oxy-2,5,7,8-tetramethylchroman-2-carboxylic acid, N-butyl ester
SpectraBase Compound ID Lek5U9o6Hgd
InChI InChI=1S/C22H34O4/c1-7-9-13-24-19-15(3)16(4)20-18(17(19)5)11-12-22(6,26-20)21(23)25-14-10-8-2/h7-14H2,1-6H3
InChIKey ZLXMBCMIAHDSHO-UHFFFAOYSA-N
Mol Weight 362.5 g/mol
Molecular Formula C22H34O4
Exact Mass 362.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2TznhyIGHOs
Name 6-(N-Butyl)oxy-2,5,7,8-tetramethylchroman-2-carboxylic acid, N-butyl ester
Comments Computed using HOSE algorithm
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Exact Mass 362.245709571 u
Formula C22H34O4
InChI InChI=1S/C22H34O4/c1-7-9-13-24-19-15(3)16(4)20-18(17(19)5)11-12-22(6,26-20)21(23)25-14-10-8-2/h7-14H2,1-6H3
InChIKey ZLXMBCMIAHDSHO-UHFFFAOYSA-N
Molecular Weight 362.510 g/mol
SMILES CC1=C2OC(C)(CCC2=C(C(=C1C)OCCCC)C)C(=O)OCCCC