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Butyl 3-bromo-2-ethynyl-5-methylbenzoate

View entire compound with spectra: 1 MS (GC)

Butyl 3-bromo-2-ethynyl-5-methylbenzoate
SpectraBase Compound ID 17RfAH5CPCo
InChI InChI=1S/C14H15BrO2/c1-4-6-7-17-14(16)12-8-10(3)9-13(15)11(12)5-2/h2,8-9H,4,6-7H2,1,3H3
InChIKey ASZLNXHXHCLHRR-UHFFFAOYSA-N
Mol Weight 295.18 g/mol
Molecular Formula C14H15BrO2
Exact Mass 294.025543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FWaU7J6YaEo
Name Butyl 3-bromo-2-ethynyl-5-methylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15BrO2
InChI InChI=1S/C14H15BrO2/c1-4-6-7-17-14(16)12-8-10(3)9-13(15)11(12)5-2/h2,8-9H,4,6-7H2,1,3H3
InChIKey ASZLNXHXHCLHRR-UHFFFAOYSA-N
Molecular Weight 295.176 g/mol
SMILES c1(c(C#C)c(Br)cc(c1)C)C(=O)OCCCC
SPLASH splash10-000l-0090000000-1c24d3ee2e5999bd8bcf
Source of Spectrum KC-0-930-7
Synonyms 3-Bromo-2-ethynyl-5-methyl-benzoic acid butyl ester Butyl 3-bromanyl-2-ethynyl-5-methyl-benzoate 3-Bromo-2-ethynyl-5-methylbenzoic acid butyl ester
Wiley ID 830357