2-(4,4-Dimethyl-4,5-dihydro-1,3-oxazol-2-yl)benzyl 4-(tert-butyl)benzoate

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Systematic / IUPAC Name: 2-(4,4-Dimethyl-4,5-dihydro-1,3-oxazol-2-yl)benzyl 4-(2-methyl-2-propanyl)benzoate

ID: Reference3841

Other Names: Benzoic acid, 4-(1,1-dimethylethyl)-, [2-(4,5-dihydro-4,4-dimethyl-2-oxazolyl)phenyl]methyl ester

Formula: C23H27NO3

Spectral Data

2-(4,4-Dimethyl-4,5-dihydro-1,3-oxazol-2-yl)benzyl 4-(tert-butyl)benzoate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 4/25/2017 7:09:25 AM
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Identificators

InChI InChI=1S/C23H27NO3/c1-22(2,3)18-12-10-16(11-13-18)21(25)26-14-17-8-6-7-9-19(17)20-24-23(4,5)15-27-20/h6-13H,14-15H2,1-5H3
InChI Key DUJQMVHISMNNPF-UHFFFAOYSA-N
Canonical SMILES CC1(COC(=N1)C2=CC=CC=C2COC(=O)C3=CC=C(C=C3)C(C)(C)C)C
CAS
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Other Names Benzoic acid, 4-(1,1-dimethylethyl)-, [2-(4,5-dihydro-4,4-dimethyl-2-oxazolyl)phenyl]methyl ester

In Other Databases

PubChem 2732889
ChemSpider 2014702