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4-(3-hydroxy-3-methyl-but-1-ynyl)benzoic acid ethyl ester
SpectraBase Compound ID 1Osn9CvSqGE
InChI InChI=1S/C14H16O3/c1-4-17-13(15)12-7-5-11(6-8-12)9-10-14(2,3)16/h5-8,16H,4H2,1-3H3
InChIKey GMIVBWHJTDDLAH-UHFFFAOYSA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CLw93igR3u
Name 4-(3-hydroxy-3-methyl-but-1-ynyl)benzoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O3
InChI InChI=1S/C14H16O3/c1-4-17-13(15)12-7-5-11(6-8-12)9-10-14(2,3)16/h5-8,16H,4H2,1-3H3
InChIKey GMIVBWHJTDDLAH-UHFFFAOYSA-N
Molecular Weight 232.279 g/mol
SMILES OC(C#Cc1ccc(C(=O)OCC)cc1)(C)C
SPLASH splash10-014i-0290000000-b2b5c3322f694cbd79f1
Source of Spectrum H-85-1881-4
Synonyms Ethyl 4-(3-hydroxy-3-methyl-but-1-ynyl)benzoate Ethyl 4-(3-methyl-3-oxidanyl-but-1-ynyl)benzoate 4-(3-hydroxy-3-methylbut-1-ynyl)benzoic acid ethyl ester
Wiley ID 1524584