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(4S,14S)-3,3,14-trimethyl-4-oxidanyl-1-oxacyclotetradecan-2-one
SpectraBase Compound ID 46SE1NjavIz
InChI InChI=1S/C16H30O3/c1-13-11-9-7-5-4-6-8-10-12-14(17)16(2,3)15(18)19-13/h13-14,17H,4-12H2,1-3H3/t13-,14-/m0/s1
InChIKey XTSHTTRFPFFOPH-KBPBESRZSA-N
Mol Weight 270.41 g/mol
Molecular Formula C16H30O3
Exact Mass 270.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CKSj5y4eo93
Name (4S,14S)-3,3,14-trimethyl-4-oxidanyl-1-oxacyclotetradecan-2-one
Comments Removed - unrepairable contamination (CH2Cl2)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H30O3
InChI InChI=1S/C16H30O3/c1-13-11-9-7-5-4-6-8-10-12-14(17)16(2,3)15(18)19-13/h13-14,17H,4-12H2,1-3H3/t13-,14-/m0/s1
InChIKey XTSHTTRFPFFOPH-KBPBESRZSA-N
Molecular Weight 270.413 g/mol
SMILES O[C@@]1(C(C(O[C@@](C)(CCCCCCCCC1)[H])=O)(C)C)[H]
SPLASH splash10-000i-9000000000-aef5fabef792b27e6a9e
Source of Spectrum J-59-7394-17
Synonyms (4S,14S)-4-hydroxy-3,3,14-trimethyl-oxacyclotetradecan-2-one
Wiley ID 1274501