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(2S,3R,4R)-4-Isopentyl-2-methyl-5-oxotetrahydrofuran-3-yl propionate
SpectraBase Compound ID 3JxA3c68eiK
InChI InChI=1S/C13H22O4/c1-5-11(14)17-12-9(4)16-13(15)10(12)7-6-8(2)3/h8-10,12H,5-7H2,1-4H3/t9-,10+,12-/m0/s1
InChIKey HYNMBCWBRXDMON-UMNHJUIQSA-N
Mol Weight 242.31 g/mol
Molecular Formula C13H22O4
Exact Mass 242.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5WgNWQ4uDBs
Name (2S,3R,4R)-4-Isopentyl-2-methyl-5-oxotetrahydrofuran-3-yl propionate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O4
InChI InChI=1S/C13H22O4/c1-5-11(14)17-12-9(4)16-13(15)10(12)7-6-8(2)3/h8-10,12H,5-7H2,1-4H3/t9-,10+,12-/m0/s1
InChIKey HYNMBCWBRXDMON-UMNHJUIQSA-N
Literature Reference DOI 10.1002/cbic.201200260
Molecular Weight 242.315 g/mol
SMILES C1(O[C@]([C@@]([C@]1(CCC(C)C)[H])(OC(CC)=O)[H])(C)[H])=O
SPLASH splash10-0a4j-9200000000-913d46cdbca54a849197
Source of Spectrum CBC-13-1635/SM36-74
Wiley ID 1786770