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(2E,4E)-5-[(3S,4S)-3,4-dihydroxy-2,6,6-trimethyl-1-cyclohexenyl]-3-methylpenta-2,4-dienoic acid methyl ester
SpectraBase Compound ID 5jROF2Db3Vy
InChI InChI=1S/C16H24O4/c1-10(8-14(18)20-5)6-7-12-11(2)15(19)13(17)9-16(12,3)4/h6-8,13,15,17,19H,9H2,1-5H3/b7-6+,10-8+/t13-,15-/m0/s1
InChIKey FSLHBLGHCRBISG-OAZUXRROSA-N
Mol Weight 280.36 g/mol
Molecular Formula C16H24O4
Exact Mass 280.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLTtd9fc0OA
Name (2E,4E)-5-[(3S,4S)-3,4-dihydroxy-2,6,6-trimethyl-1-cyclohexenyl]-3-methylpenta-2,4-dienoic acid methyl ester
CAS Registry Number 130930-83-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O4
InChI InChI=1S/C16H24O4/c1-10(8-14(18)20-5)6-7-12-11(2)15(19)13(17)9-16(12,3)4/h6-8,13,15,17,19H,9H2,1-5H3/b7-6+,10-8+/t13-,15-/m0/s1
InChIKey FSLHBLGHCRBISG-OAZUXRROSA-N
Molecular Weight 280.364 g/mol
SMILES O[C@]1(C(=C(C(C[C@@]1(O)[H])(C)C)\C=C\C(=C\C(=O)OC)C)C)[H]
SPLASH splash10-0l2k-0930000000-d23f2b672007959aa167
Source of Spectrum H-73-1014-20
Synonyms (2E,4E)-5-[(3S,4S)-3,4-dihydroxy-2,6,6-trimethyl-cyclohexen-1-yl]-3-methyl-penta-2,4-dienoic acid methyl ester Methyl (2E,4E)-3-methyl-5-[(3S,4S)-2,6,6-trimethyl-3,4-bis(oxidanyl)cyclohexen-1-yl]penta-2,4-dienoate Methyl (2E,4E)-5-[(3S,4S)-3,4-dihydroxy-2,6,6-trimethyl-cyclohexen-1-yl]-3-methyl-penta-2,4-dienoate
Wiley ID 1283961