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Oxirane, 2-[(3-pentyloxiranyl)methyl]-3-undecyl-, [2R-[2.alpha.(2S*,3R*),3.alpha.]]-
SpectraBase Compound ID TEEVo42WNs
InChI InChI=1S/C21H40O2/c1-3-5-7-8-9-10-11-12-14-16-19-21(23-19)17-20-18(22-20)15-13-6-4-2/h18-21H,3-17H2,1-2H3/t18-,19+,20+,21-/m1/s1
InChIKey PDRNHNBPVZWTJP-IVAOSVALSA-N
Mol Weight 324.5 g/mol
Molecular Formula C21H40O2
Exact Mass 324.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2updzYLGRbi
Name Oxirane, 2-[(3-pentyloxiranyl)methyl]-3-undecyl-, [2R-[2.alpha.(2S*,3R*),3.alpha.]]-
CAS Registry Number 129436-94-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40O2
InChI InChI=1S/C21H40O2/c1-3-5-7-8-9-10-11-12-14-16-19-21(23-19)17-20-18(22-20)15-13-6-4-2/h18-21H,3-17H2,1-2H3/t18-,19+,20+,21-/m1/s1
InChIKey PDRNHNBPVZWTJP-IVAOSVALSA-N
Molecular Weight 324.549 g/mol
SMILES [C@]1(O[C@]1(CCCCCCCCCCC)[H])(C[C@@]1(O[C@@]1(CCCCC)[H])[H])[H]
SPLASH splash10-001j-9400000000-8a919414e11fc4547af1
Source of Spectrum B-43-910-16
Synonyms (2R,3S)-2-{[(2S,3R)-3-pentyloxiran-2-yl]methyl}-3-undecyloxirane (6R,7S,9R,10S)-6,7,9,10-bisepoxyhenicosane (6R,7S,9R,10S)-6,7:9,10-bis(epoxy)heneicosane
Wiley ID 1323657