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2H-Pyran-3-ol, 3,6-dihydro-4-methyl-6-[2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3-butadienyl]-, acetate, [3.alpha.,6.alpha.(1E,3E)]-(.+-.)-

View entire compound with spectra: 1 MS (GC)

2H-Pyran-3-ol, 3,6-dihydro-4-methyl-6-[2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3-butadienyl]-, acetate, [3.alpha.,6.alpha.(1E,3E)]-(.+-.)-
SpectraBase Compound ID 1cQLsgvmQeN
InChI InChI=1S/C22H32O3/c1-15(9-10-20-16(2)8-7-11-22(20,5)6)12-19-13-17(3)21(14-24-19)25-18(4)23/h9-10,12-13,19,21H,7-8,11,14H2,1-6H3/b10-9+,15-12+/t19-,21-/m0/s1
InChIKey OFNUTJYDNGCJHB-LIHYWDMFSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H32O3
Exact Mass 344.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fmZkRyJyQQ
Name 2H-Pyran-3-ol, 3,6-dihydro-4-methyl-6-[2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3-butadienyl]-, acetate, [3.alpha.,6.alpha.(1E,3E)]-(.+-.)-
CAS Registry Number 76461-34-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O3
InChI InChI=1S/C22H32O3/c1-15(9-10-20-16(2)8-7-11-22(20,5)6)12-19-13-17(3)21(14-24-19)25-18(4)23/h9-10,12-13,19,21H,7-8,11,14H2,1-6H3/b10-9+,15-12+/t19-,21-/m0/s1
InChIKey OFNUTJYDNGCJHB-LIHYWDMFSA-N
Molecular Weight 344.495 g/mol
SMILES C1(\C=C\C(=C\[C@]2(C=C(C)[C@](CO2)(OC(=O)C)[H])[H])C)=C(CCCC1(C)C)C
SPLASH splash10-0292-3931000000-aa71c04e70b206fc4fac
Source of Spectrum F-36-1182-0
Synonyms (3R,6S)-4-methyl-6-[(1E,3E)-2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3-butadienyl]-3,6-dihydro-2H-pyran-3-yl acetate Acetate of (+,-)-[2.alpha.(1E,3E),3.alpha.]-3,6-dihydro-4-methyl-2-[2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3-butadienyl]-2H-pyran-3-ol
Wiley ID 1338247