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Methyl ester of (E)-5-methyl-4-(phenylazo)hexanoic acid
SpectraBase Compound ID 3850e0MSv30
InChI InChI=1S/C14H20N2O2/c1-11(2)13(9-10-14(17)18-3)16-15-12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3/b16-15+
InChIKey IIQVGVYRPQPGER-FOCLMDBBSA-N
Mol Weight 248.33 g/mol
Molecular Formula C14H20N2O2
Exact Mass 248.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8YHFpvpoImF
Name Methyl ester of (E)-5-methyl-4-(phenylazo)hexanoic acid
Alternate Name(s) Methyl 5-methyl-4-[(E)-phenyldiazenyl]hexanoate
CAS Registry Number 68184-51-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20N2O2
InChI InChI=1S/C14H20N2O2/c1-11(2)13(9-10-14(17)18-3)16-15-12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3/b16-15+
InChIKey IIQVGVYRPQPGER-FOCLMDBBSA-N
Molecular Weight 248.326 g/mol
SMILES c1(\N=N\C(CCC(=O)OC)C(C)C)ccccc1
SPLASH splash10-01u3-8900000000-6a704eccacc889e09214
Source of Spectrum J-44-219-0
Wiley ID 1251134