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2-Pentenoic acid, 2,4-dimethyl-, 3-methyl-2-butenyl ester, (E)-
SpectraBase Compound ID Imk4kODYNsM
InChI InChI=1S/C12H20O2/c1-9(2)6-7-14-12(13)11(5)8-10(3)4/h6,8,10H,7H2,1-5H3/b11-8+
InChIKey HKTAYJPMNDAYJQ-DHZHZOJOSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HX50GNIi9Ne
Name 2-Pentenoic acid, 2,4-dimethyl-, 3-methyl-2-butenyl ester, (E)-
Alternate Name(s) 3-Methyl-2-butenyl (2E)-2,4-dimethyl-2-pentenoate 3-Methyl-2-butenyl 2,4-dimethyl-2-pentenoate
CAS Registry Number 125427-45-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-9(2)6-7-14-12(13)11(5)8-10(3)4/h6,8,10H,7H2,1-5H3/b11-8+
InChIKey HKTAYJPMNDAYJQ-DHZHZOJOSA-N
Molecular Weight 196.290 g/mol
SMILES C(\C(=C\C(C)C)C)(=O)OCC=C(C)C
SPLASH splash10-014i-9400000000-bf4ce928ef2c68af6116
Source of Spectrum F-45-6185-7
Wiley ID 1193591