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2-Diazo-4-(2-methyl-propyl)-3-oxo-7-octenoic acid, methyl ester
SpectraBase Compound ID 7gv91uhyMtJ
InChI InChI=1S/C13H20N2O3/c1-5-6-7-10(8-9(2)3)12(16)11(15-14)13(17)18-4/h5,9-10H,1,6-8H2,2-4H3
InChIKey VRFWMIMWNCNOKH-UHFFFAOYSA-N
Mol Weight 252.31 g/mol
Molecular Formula C13H20N2O3
Exact Mass 252.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lSuutONLtd
Name Methyl 2-diazo-4-(2-methyl-1-propyl)-3-oxooct-7-enoate
Alternate Name(s) Methyl 2-diazo-4-isobutyl-3-oxo-7-octenoate
CAS Registry Number 104620-20-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20N2O3
InChI InChI=1S/C13H20N2O3/c1-5-6-7-10(8-9(2)3)12(16)11(15-14)13(17)18-4/h5,9-10H,1,6-8H2,2-4H3
InChIKey VRFWMIMWNCNOKH-UHFFFAOYSA-N
Molecular Weight 252.314 g/mol
SMILES C(C(C(CC(C)C)CCC=C)=O)(=[N+]=[N-])C(=O)OC
SPLASH splash10-0pbi-0900000000-39a8690b3aaa82d227a1
Source of Spectrum C-108-7689-8
Wiley ID 1255427