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(3S,4S)-3-(8-methylnonyl)-4-[(2R)-2-oxidanylnonyl]oxetan-2-one
SpectraBase Compound ID F5kPUuH30yC
InChI InChI=1S/C22H42O3/c1-4-5-6-8-12-15-19(23)17-21-20(22(24)25-21)16-13-10-7-9-11-14-18(2)3/h18-21,23H,4-17H2,1-3H3/t19-,20+,21+/m1/s1
InChIKey QUYKOGHNCDRUOE-HKBOAZHASA-N
Mol Weight 354.6 g/mol
Molecular Formula C22H42O3
Exact Mass 354.313395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WN5ORdAuot
Name (3S,4S)-3-(8-methylnonyl)-4-[(2R)-2-oxidanylnonyl]oxetan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H42O3
InChI InChI=1S/C22H42O3/c1-4-5-6-8-12-15-19(23)17-21-20(22(24)25-21)16-13-10-7-9-11-14-18(2)3/h18-21,23H,4-17H2,1-3H3/t19-,20+,21+/m1/s1
InChIKey QUYKOGHNCDRUOE-HKBOAZHASA-N
Molecular Weight 354.575 g/mol
SMILES O[C@@](C[C@]1([C@@](C(O1)=O)(CCCCCCCC(C)C)[H])[H])(CCCCCCC)[H]
SPLASH splash10-0159-9700000000-0d5d1b8b179e03381f69
Source of Spectrum KC-0-1378-19
Synonyms (3S,4S)-4-[(2R)-2-hydroxynonyl]-3-(8-methylnonyl)-2-oxetanone (3S,4S)-4-[(2R)-2-hydroxynonyl]-3-(8-methylnonyl)oxetan-2-one
Wiley ID 824984