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3-Butenoic acid, 4-(4-methoxy-2,3,6-trimethylphenyl)-2-methyl-, (E)-
SpectraBase Compound ID Cs3fuTVyUIj
InChI InChI=1S/C15H20O3/c1-9(15(16)17)6-7-13-10(2)8-14(18-5)12(4)11(13)3/h6-9H,1-5H3,(H,16,17)/b7-6+
InChIKey ZINUCDHAZWMNAD-VOTSOKGWSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DbPitPrPbRM
Name 3-Butenoic acid, 4-(4-methoxy-2,3,6-trimethylphenyl)-2-methyl-, (E)-
CAS Registry Number 65316-72-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-9(15(16)17)6-7-13-10(2)8-14(18-5)12(4)11(13)3/h6-9H,1-5H3,(H,16,17)/b7-6+
InChIKey ZINUCDHAZWMNAD-VOTSOKGWSA-N
Molecular Weight 248.322 g/mol
SMILES OC(C(\C=C\c1c(c(C)c(cc1C)OC)C)C)=O
SPLASH splash10-000j-0930000000-1dfa720cfa6c18ddd782
Source of Spectrum H-60-2317-3
Synonyms (3E)-4-(4-methoxy-2,3,6-trimethylphenyl)-2-methyl-3-butenoic acid Methyl trans-4-(hydroxy-2,3,6-trimethylphenyl)-2-methyl-3-butenoate
Wiley ID 1251254