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5-Hydroxy-4,4-dimethyl-2-pentynoic acid methyl ester
SpectraBase Compound ID In7qXVneMhB
InChI InChI=1S/C8H12O3/c1-8(2,6-9)5-4-7(10)11-3/h9H,6H2,1-3H3
InChIKey YSLGATWXVGMMNJ-UHFFFAOYSA-N
Mol Weight 156.18 g/mol
Molecular Formula C8H12O3
Exact Mass 156.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Q0X6TkFQ5V
Name 5-Hydroxy-4,4-dimethyl-2-pentynoic acid methyl ester
Alternate Name(s) 5-Hydroxy-4,4-dimethyl-pent-2-ynoic acid methyl ester Methyl 4,4-dimethyl-5-oxidanyl-pent-2-ynoate Methyl 5-hydroxy-4,4-dimethyl-pent-2-ynoate
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Formula C8H12O3
InChI InChI=1S/C8H12O3/c1-8(2,6-9)5-4-7(10)11-3/h9H,6H2,1-3H3
InChIKey YSLGATWXVGMMNJ-UHFFFAOYSA-N
Molecular Weight 156.181 g/mol
SMILES OCC(C#CC(=O)OC)(C)C
SPLASH splash10-00or-9400000000-d865e806e373e34e56ea
Source of Spectrum KC-0-154-15
Wiley ID 787169