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Methyl 4-tert-butylbenzoate
SpectraBase Compound ID KXajVh0IK16
InChI InChI=1S/C12H16O2/c1-12(2,3)10-7-5-9(6-8-10)11(13)14-4/h5-8H,1-4H3
InChIKey UPIJOAFHOIWPLT-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8EBFxh0Jnhq
Name Benzoic acid, 4-(1,1-dimethylethyl)-, methyl ester
CAS Registry Number 26537-19-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-12(2,3)10-7-5-9(6-8-10)11(13)14-4/h5-8H,1-4H3
InChIKey UPIJOAFHOIWPLT-UHFFFAOYSA-N
Molecular Weight 192.258 g/mol
SMILES C(C)(C)(C)c1ccc(C(OC)=O)cc1
SPLASH splash10-004i-2900000000-de381889ac408e4958e7
Source of Spectrum F-42-560-1
Synonyms Benzoic acid, p-tert-butyl-, methyl ester 4-Tert-butylbenzoic acid methyl ester Methyl 4-tert-butylbenzoate Methyl p-tert-butylbenzoate AI3-21414 EINECS 247-768-5
Wiley ID 1188614