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3-(15-hydroxyhexadecyl)-4-methyl-furan-2,5-dione

View entire compound with spectra: 1 MS (GC)

3-(15-hydroxyhexadecyl)-4-methyl-furan-2,5-dione
SpectraBase Compound ID 1ZhtKofZxu6
InChI InChI=1S/C21H36O4/c1-17(22)15-13-11-9-7-5-3-4-6-8-10-12-14-16-19-18(2)20(23)25-21(19)24/h17,22H,3-16H2,1-2H3
InChIKey LQHWACDOMXJHRQ-UHFFFAOYSA-N
Mol Weight 352.5 g/mol
Molecular Formula C21H36O4
Exact Mass 352.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KeJIJngPQSo
Name 3-(15-hydroxyhexadecyl)-4-methyl-furan-2,5-dione
CAS Registry Number 62722-99-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O4
InChI InChI=1S/C21H36O4/c1-17(22)15-13-11-9-7-5-3-4-6-8-10-12-14-16-19-18(2)20(23)25-21(19)24/h17,22H,3-16H2,1-2H3
InChIKey LQHWACDOMXJHRQ-UHFFFAOYSA-N
Molecular Weight 352.515 g/mol
SMILES OC(CCCCCCCCCCCCCCC1=C(C)C(OC1=O)=O)C
SPLASH splash10-057l-9410000000-410ced2024cabcaa84b1
Source of Spectrum KO-7-150-3
Synonyms 3-(15-hydroxyhexadecyl)-4-methyl-furan-2,5-quinone 3-Methyl-4-(15-oxidanylhexadecyl)furan-2,5-dione FURANDIONE DERIV , (5347)
Wiley ID 1343509