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2-(Dimethylamino)ethyl 4-[(4-tert-butylphenoxy)methyl]benzoate

View entire compound with spectra: 2 NMR

2-(Dimethylamino)ethyl 4-[(4-tert-butylphenoxy)methyl]benzoate
SpectraBase Compound ID 47xX0lRJOZB
InChI InChI=1S/C22H29NO3/c1-22(2,3)19-10-12-20(13-11-19)26-16-17-6-8-18(9-7-17)21(24)25-15-14-23(4)5/h6-13H,14-16H2,1-5H3
InChIKey XCPSJSPFOHDFLZ-UHFFFAOYSA-N
Mol Weight 355.48 g/mol
Molecular Formula C22H29NO3
Exact Mass 355.214744 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LM5P2qroUL4
Name 2-(Dimethylamino)ethyl 4-[(4-tert-butylphenoxy)methyl]benzoate
Comments Computed using HOSE algorithm
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Exact Mass 355.214743795 u
Formula C22H29NO3
InChI InChI=1S/C22H29NO3/c1-22(2,3)19-10-12-20(13-11-19)26-16-17-6-8-18(9-7-17)21(24)25-15-14-23(4)5/h6-13H,14-16H2,1-5H3
InChIKey XCPSJSPFOHDFLZ-UHFFFAOYSA-N
Molecular Weight 355.478 g/mol
SMILES C(C=1C=CC(=CC1)COC=1C=CC(C(C)(C)C)=CC1)(=O)OCCN(C)C