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Methyl 2,5-dimethyl-5-hydroxy-2-hexenoate
SpectraBase Compound ID 3GrhyCRXYQI
InChI InChI=1S/C9H16O3/c1-7(8(10)12-4)5-6-9(2,3)11/h5,11H,6H2,1-4H3/b7-5-
InChIKey JGRUMCXASJVDGB-ALCCZGGFSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1nazLPREwOg
Name Methyl 2,5-dimethyl-5-hydroxy-2-hexenoate
Alternate Name(s) Methyl (2Z)-5-hydroxy-2,5-dimethyl-2-hexenoate
CAS Registry Number 92186-94-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-7(8(10)12-4)5-6-9(2,3)11/h5,11H,6H2,1-4H3/b7-5-
InChIKey JGRUMCXASJVDGB-ALCCZGGFSA-N
Molecular Weight 172.224 g/mol
SMILES OC(C\C=C/(C(=O)OC)C)(C)C
SPLASH splash10-0bt9-0900000000-2cb7c688e1da71c05f34
Source of Spectrum J-49-4428-0
Wiley ID 1168671