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(1SR,2SR,3SR)-1-Ethyl-3-hydroxy-2-methylhexyl butanoate
SpectraBase Compound ID A0MsQJjDbT8
InChI InChI=1S/C13H26O3/c1-5-8-11(14)10(4)12(7-3)16-13(15)9-6-2/h10-12,14H,5-9H2,1-4H3/t10-,11-,12-/m1/s1
InChIKey VKVOWUKERGKPTA-IJLUTSLNSA-N
Mol Weight 230.35 g/mol
Molecular Formula C13H26O3
Exact Mass 230.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Los8QvHmhVd
Name (1SR,2SR,3SR)-1-Ethyl-3-hydroxy-2-methylhexyl butanoate
Alternate Name(s) 1-Ethyl-3-hydroxy-2-methylhexyl butyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H26O3
InChI InChI=1S/C13H26O3/c1-5-8-11(14)10(4)12(7-3)16-13(15)9-6-2/h10-12,14H,5-9H2,1-4H3/t10-,11-,12-/m1/s1
InChIKey VKVOWUKERGKPTA-IJLUTSLNSA-N
Molecular Weight 230.348 g/mol
SMILES O[C@@]([C@]([C@](OC(=O)CCC)(CC)[H])(C)[H])(CCC)[H]
SPLASH splash10-00ei-9100000000-eca7eeb54892022196da
Source of Spectrum SO-0-1089-3
Wiley ID 874021