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4-Hydroxy-4-isopropyl-5-methyl-2-hexynyl acetate
SpectraBase Compound ID 4TJ9m0ueAJw
InChI InChI=1S/C12H20O3/c1-9(2)12(14,10(3)4)7-6-8-15-11(5)13/h9-10,14H,8H2,1-5H3
InChIKey ORKUKHPLTGQGBX-UHFFFAOYSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mSW5O4dLCb
Name 4-Hydroxy-4-isopropyl-5-methyl-2-hexynyl acetate
CAS Registry Number 70372-90-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-9(2)12(14,10(3)4)7-6-8-15-11(5)13/h9-10,14H,8H2,1-5H3
InChIKey ORKUKHPLTGQGBX-UHFFFAOYSA-N
Molecular Weight 212.289 g/mol
SMILES OC(C(C)C)(C(C)C)C#CCOC(=O)C
SPLASH splash10-016u-9500000000-6a08ec94419f88430174
Synonyms (4-hydroxy-4-isopropyl-5-methyl-hex-2-ynyl) acetate (4-hydroxy-5-methyl-4-propan-2-ylhex-2-ynyl) acetate (5-methyl-4-oxidanyl-4-propan-2-yl-hex-2-ynyl) ethanoate Acetic acid (4-hydroxy-4-isopropyl-5-methyl-hex-2-ynyl) ester Acetic acid (4-hydroxy-5-methyl-4-propan-2-ylhex-2-ynyl) ester
Wiley ID 1478482