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(2S)-2-methyl-4-[(13R)-13-oxidanyl-14-[2-[(2S)-2-oxidanyldodecoxy]ethoxy]tetradecyl]-2H-furan-5-one
SpectraBase Compound ID JpM98mmvAG9
InChI InChI=1S/C33H62O6/c1-3-4-5-6-7-13-16-19-22-31(34)27-37-24-25-38-28-32(35)23-20-17-14-11-9-8-10-12-15-18-21-30-26-29(2)39-33(30)36/h26,29,31-32,34-35H,3-25,27-28H2,1-2H3/t29-,31-,32+/m0/s1
InChIKey PRVOOBNOHIXRII-RUHGTMQNSA-N
Mol Weight 554.9 g/mol
Molecular Formula C33H62O6
Exact Mass 554.45464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zUKDGGblUb
Name (2S)-2-methyl-4-[(13R)-13-oxidanyl-14-[2-[(2S)-2-oxidanyldodecoxy]ethoxy]tetradecyl]-2H-furan-5-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H62O6
InChI InChI=1S/C33H62O6/c1-3-4-5-6-7-13-16-19-22-31(34)27-37-24-25-38-28-32(35)23-20-17-14-11-9-8-10-12-15-18-21-30-26-29(2)39-33(30)36/h26,29,31-32,34-35H,3-25,27-28H2,1-2H3/t29-,31-,32+/m0/s1
InChIKey PRVOOBNOHIXRII-RUHGTMQNSA-N
Molecular Weight 554.853 g/mol
SMILES O[C@@](COCCOC[C@@](O)(CCCCCCCCCC)[H])(CCCCCCCCCCCCC=1C(O[C@@](C)(C1)[H])=O)[H]
SPLASH splash10-0002-0092000000-600e5e864ccbc618678c
Source of Spectrum QF-9-289-2
Synonyms (2S)-4-[(13R)-13-hydroxy-14-[2-[(2S)-2-hydroxydodecoxy]ethoxy]tetradecyl]-2-methyl-2H-furan-5-one
Wiley ID 1558188