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2-ACETOXY-1-ISOPROPYL-4-METHYLBENZENE
SpectraBase Compound ID INvj5DRDnaD
InChI InChI=1S/C12H16O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h5-8H,1-4H3
InChIKey WFMIUXMJJBBOGJ-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 1HNe9x2M8oa
Name Phenol, 5-methyl-2-(1-methylethyl)-, acetate
CAS Registry Number 528-79-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h5-8H,1-4H3
InChIKey WFMIUXMJJBBOGJ-UHFFFAOYSA-N
Molecular Weight 192.258 g/mol
SMILES C(C)(C)c1c(OC(C)=O)cc(C)cc1
SPLASH splash10-000i-4900000000-1fc7631217b7cfb418e8
Source of Spectrum UT-1990-1331-0
Synonyms Thymol, acetate 2-Isopropyl-5-methylphenyl acetate (5-methyl-2-propan-2-yl-phenyl) ethanoate (5-methyl-2-propan-2-ylphenyl) acetate Acetic acid (2-isopropyl-5-methyl-phenyl) ester Acetic acid (5-methyl-2-propan-2-ylphenyl) ester Acetyl thymol O-Acetylthymol Thymyl acetate AI3-03427 EINECS 208-442-8 NSC 406522
Wiley ID 1188611