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3-Hydroxy-2,6,6-trimethyl-hept-4-enoic acid
SpectraBase Compound ID 34zJcYyxONB
InChI InChI=1S/C10H18O3/c1-7(9(12)13)8(11)5-6-10(2,3)4/h5-8,11H,1-4H3,(H,12,13)/b6-5+
InChIKey HMRKOONSKVPDCJ-AATRIKPKSA-N
Mol Weight 186.25 g/mol
Molecular Formula C10H18O3
Exact Mass 186.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nxUCrBdqnq
Name 3-Hydroxy-2,6,6-trimethyl-hept-4-enoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O3
InChI InChI=1S/C10H18O3/c1-7(9(12)13)8(11)5-6-10(2,3)4/h5-8,11H,1-4H3,(H,12,13)/b6-5+
InChIKey HMRKOONSKVPDCJ-AATRIKPKSA-N
Molecular Weight 186.251 g/mol
SMILES OC(C(C(\C=C\C(C)(C)C)O)C)=O
SPLASH splash10-06r7-9300000000-937d6cca2dbb4fdee4ff
Synonyms (4E)-3-Hydroxy-2,6,6-trimethyl-4-heptenoic acid (E)-3-hydroxy-2,6,6-trimethylhept-4-enoic acid (E)-2,6,6-trimethyl-3-oxidanyl-hept-4-enoic acid (E)-3-hydroxy-2,6,6-trimethyl-4-heptenoic acid (E)-3-hydroxy-2,6,6-trimethyl-hept-4-enoic acid
Wiley ID 1489747