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(1RS,2SR)-2-Methyl-3-oxo-1-[(E)-prop-1'-enyl]pentyl propanoate
SpectraBase Compound ID AOOKuCIpMXY
InChI InChI=1S/C12H20O3/c1-5-8-11(15-12(14)7-3)9(4)10(13)6-2/h5,8-9,11H,6-7H2,1-4H3/b8-5+
InChIKey BTOFATNUIRYATA-VMPITWQZSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Wig9lOtQEH
Name (1RS,2SR)-2-Methyl-3-oxo-1-[(E)-prop-1'-enyl]pentyl propanoate
Alternate Name(s) (2E)-1-(1-methyl-2-oxobutyl)-2-butenyl propionate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-5-8-11(15-12(14)7-3)9(4)10(13)6-2/h5,8-9,11H,6-7H2,1-4H3/b8-5+
InChIKey BTOFATNUIRYATA-VMPITWQZSA-N
Molecular Weight 212.289 g/mol
SMILES C(C(C(=O)CC)C)(OC(=O)CC)\C=C\C
SPLASH splash10-0a4i-9000000000-6a48b522d0fd914c8dea
Source of Spectrum H-76-1288-6
Wiley ID 1211578