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Methyl (2RS, 3SR)-3-methyl-2-(propanoyloxy)pentanoate
SpectraBase Compound ID 9iHOZjUV8Z8
InChI InChI=1S/C10H18O4/c1-5-7(3)9(10(12)13-4)14-8(11)6-2/h7,9H,5-6H2,1-4H3/t7-,9+/m0/s1
InChIKey XZYLWGKRZUNUGE-IONNQARKSA-N
Mol Weight 202.25 g/mol
Molecular Formula C10H18O4
Exact Mass 202.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FBroHVtCwL
Name Methyl (2RS, 3SR)-3-methyl-2-(propanoyloxy)pentanoate
Classification Fatty acid esters
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 202.120509056 u
Formula C10H18O4
InChI InChI=1S/C10H18O4/c1-5-7(3)9(10(12)13-4)14-8(11)6-2/h7,9H,5-6H2,1-4H3/t7-,9+/m0/s1
InChIKey XZYLWGKRZUNUGE-IONNQARKSA-N
Molecular Weight 202.250 g/mol
Number of Peaks 6
SMILES CC[C@](C)([C@@](OC(=O)CC)(C(OC)=O)[H])[H]
SPLASH splash10-0a4i-9000000000-31f3f126a9a5a2140861
Source of Spectrum FF-20-378-20 (DOI: 10.1002/ffj.1510)
Synonyms (2R,3S)-methyl 3-methyl-2-(propionyloxy)pentanoate
Wiley ID 1775401