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3,4-XYLYL 3,5-DI-tert-BUTYLBENZOATE

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3,4-XYLYL 3,5-DI-tert-BUTYLBENZOATE
SpectraBase Compound ID CU7h0PGlPWX
InChI InChI=1S/C23H30O2/c1-15-9-10-20(11-16(15)2)25-21(24)17-12-18(22(3,4)5)14-19(13-17)23(6,7)8/h9-14H,1-8H3
InChIKey BAILKEIRZMRLMJ-UHFFFAOYSA-N
Mol Weight 338.49 g/mol
Molecular Formula C23H30O2
Exact Mass 338.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID abU78g0517
Name 3,4-Dimethylphenyl 3,5-ditert-butylbenzoate
Alternate Name(s) 3,4-Xylyl 3,5-di-tert-butylbenzoate 3,5-Ditert-butylbenzoic acid (3,4-dimethylphenyl) ester
CAS Registry Number 293761-66-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O2
InChI InChI=1S/C23H30O2/c1-15-9-10-20(11-16(15)2)25-21(24)17-12-18(22(3,4)5)14-19(13-17)23(6,7)8/h9-14H,1-8H3
InChIKey BAILKEIRZMRLMJ-UHFFFAOYSA-N
Molecular Weight 338.491 g/mol
SMILES c1(ccc(cc1C)OC(=O)c1cc(cc(c1)C(C)(C)C)C(C)(C)C)C
SPLASH splash10-014i-9580000000-77bf9b2e9cfc81ffb098
Wiley ID 1468400