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(2E)-5-[(1RS,4S)-1,4-Dihydroxy-2,6,6-trimethylcyclohex-2-enyl]-3-methyl-2-penten-4-ynol
SpectraBase Compound ID FaJfVWEDtG3
InChI InChI=1S/C15H22O3/c1-11(6-8-16)5-7-15(18)12(2)9-13(17)10-14(15,3)4/h6,9,13,16-18H,8,10H2,1-4H3/b11-6+/t13-,15?/m1/s1
InChIKey GKOZUGVAGBCEQL-PTHPMJRESA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6doBNjdABhx
Name (2E)-5-[(1RS,4S)-1,4-Dihydroxy-2,6,6-trimethylcyclohex-2-enyl]-3-methyl-2-penten-4-ynol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-11(6-8-16)5-7-15(18)12(2)9-13(17)10-14(15,3)4/h6,9,13,16-18H,8,10H2,1-4H3/b11-6+/t13-,15?/m1/s1
InChIKey GKOZUGVAGBCEQL-PTHPMJRESA-N
Molecular Weight 250.338 g/mol
SMILES OC\C=C\(C#CC1(C(=C[C@](CC1(C)C)(O)[H])C)O)C
SPLASH splash10-002f-5900000000-27cc927b22989d0a41e1
Source of Spectrum SB-51-1210-22
Synonyms (4S)-1-[(3E)-5-hydroxy-3-methyl-3-penten-1-ynyl]-2,6,6-trimethyl-2-cyclohexene-1,4-diol
Wiley ID 1253711