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(R)-3-Methyl-4-((2S,4S)-4-methyl-5-oxotetrahydrofuran-2-yl)butanal
SpectraBase Compound ID 1tAXk14imvM
InChI InChI=1S/C10H16O3/c1-7(3-4-11)5-9-6-8(2)10(12)13-9/h4,7-9H,3,5-6H2,1-2H3/t7-,8-,9-/m0/s1
InChIKey MLSUVDRKQZEPDR-CIUDSAMLSA-N
Mol Weight 184.23 g/mol
Molecular Formula C10H16O3
Exact Mass 184.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1RWxenX302f
Name (R)-3-Methyl-4-((2S,4S)-4-methyl-5-oxotetrahydrofuran-2-yl)butanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O3
InChI InChI=1S/C10H16O3/c1-7(3-4-11)5-9-6-8(2)10(12)13-9/h4,7-9H,3,5-6H2,1-2H3/t7-,8-,9-/m0/s1
InChIKey MLSUVDRKQZEPDR-CIUDSAMLSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201804988
Molecular Weight 184.235 g/mol
Optical Rotation [a]D20 = -31.5 (c = 1.1, CHCl3)
Reported Formula C10H16O3
SMILES [C@]1(C[C@](CC=O)(C)[H])(OC([C@](C1)(C)[H])=O)[H]
SPLASH splash10-006t-9000000000-bafc8619be12ce2dcc82
Source of Spectrum QE-25-SM7-S8
Wiley ID 1846020