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(1S,2S)-1-Acetoxy-2-(6-m-methoxyphenyl-3-oxohexyl)-2,4,4-trimethylcyclopenta-3-one
SpectraBase Compound ID 4ZIZuoPp94S
InChI InChI=1S/C23H32O5/c1-16(24)28-20-15-22(2,3)21(26)23(20,4)13-12-18(25)10-6-8-17-9-7-11-19(14-17)27-5/h7,9,11,14,20H,6,8,10,12-13,15H2,1-5H3/t20-,23-/m0/s1
InChIKey LILNZRKDBAHAFL-REWPJTCUSA-N
Mol Weight 388.5 g/mol
Molecular Formula C23H32O5
Exact Mass 388.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTNcTwgNpWf
Name (1S,2S)-1-Acetoxy-2-(6-m-methoxyphenyl-3-oxohexyl)-2,4,4-trimethylcyclopenta-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32O5
InChI InChI=1S/C23H32O5/c1-16(24)28-20-15-22(2,3)21(26)23(20,4)13-12-18(25)10-6-8-17-9-7-11-19(14-17)27-5/h7,9,11,14,20H,6,8,10,12-13,15H2,1-5H3/t20-,23-/m0/s1
InChIKey LILNZRKDBAHAFL-REWPJTCUSA-N
Molecular Weight 388.504 g/mol
SMILES [C@@]1(C(C(C)(C)C[C@@]1(OC(=O)C)[H])=O)(CCC(=O)CCCc1cc(OC)ccc1)C
SPLASH splash10-001i-0901000000-59dfe4cda1f60b25e6f2
Source of Spectrum QC-8-3057-8
Synonyms (1S,2S)-2-[6-(3-methoxyphenyl)-3-oxohexyl]-2,4,4-trimethyl-3-oxocyclopentyl acetate
Wiley ID 870237