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2-(3-Methylbutyl)-5-hexynoic acid
SpectraBase Compound ID 6LOKERX4boi
InChI InChI=1S/C11H18O2/c1-4-5-6-10(11(12)13)8-7-9(2)3/h1,9-10H,5-8H2,2-3H3,(H,12,13)
InChIKey RMVLEYLYNCVGIH-UHFFFAOYSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PlaNjOvzGE
Name 2-(3-Methylbutyl)-5-hexynoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-4-5-6-10(11(12)13)8-7-9(2)3/h1,9-10H,5-8H2,2-3H3,(H,12,13)
InChIKey RMVLEYLYNCVGIH-UHFFFAOYSA-N
Molecular Weight 182.263 g/mol
SMILES OC(=O)C(CCC(C)C)CCC#C
SPLASH splash10-01oy-9600000000-c9df804ceebf69320cdb
Source of Spectrum J-58-1907-34
Synonyms 2-(3-Methylbutyl)hex-5-ynoic acid 2-isoamylhex-5-ynoic acid 2-isopentylhex-5-ynoic acid
Wiley ID 1178910