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4-hydroxy-4-methyl-pent-2-ynoic acid methyl ester
SpectraBase Compound ID 9AY6T7e0QFA
InChI InChI=1S/C7H10O3/c1-7(2,9)5-4-6(8)10-3/h9H,1-3H3
InChIKey JYWXWZYQRNCVPV-UHFFFAOYSA-N
Mol Weight 142.15 g/mol
Molecular Formula C7H10O3
Exact Mass 142.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Xc5HPg53zY
Name 4-hydroxy-4-methyl-pent-2-ynoic acid methyl ester
Alternate Name(s) Methyl 4-Hydroxy-4-methyl-2-pentynoate 4-hydroxy-4-methyl-2-pentynoic acid methyl ester methyl 4-hydroxy-4-methyl-pent-2-ynoate methyl 4-methyl-4-oxidanyl-pent-2-ynoate
Comments Less than 3 mono-isotopic peaks
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Formula C7H10O3
InChI InChI=1S/C7H10O3/c1-7(2,9)5-4-6(8)10-3/h9H,1-3H3
InChIKey JYWXWZYQRNCVPV-UHFFFAOYSA-N
Molecular Weight 142.154 g/mol
SMILES OC(C#CC(=O)OC)(C)C
SPLASH splash10-004i-0900000000-6c696de48f00baa04cea
Source of Spectrum SO-0-13-1
Wiley ID 1541952