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4-Pentenoic acid, 3,3-dimethyl-2-(2-propynyl)-, methyl ester
SpectraBase Compound ID B6VZOC7kVwm
InChI InChI=1S/C11H16O2/c1-6-8-9(10(12)13-5)11(3,4)7-2/h1,7,9H,2,8H2,3-5H3
InChIKey NJEIIFVMWVSYHI-UHFFFAOYSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lc0iXLweHJZ
Name 4-Pentenoic acid, 3,3-dimethyl-2-(2-propynyl)-, methyl ester
CAS Registry Number 119548-51-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-6-8-9(10(12)13-5)11(3,4)7-2/h1,7,9H,2,8H2,3-5H3
InChIKey NJEIIFVMWVSYHI-UHFFFAOYSA-N
Molecular Weight 180.247 g/mol
SMILES C(C(C(C=C)(C)C)CC#C)(=O)OC
SPLASH splash10-01b9-9700000000-78062db4f66008bbe083
Source of Spectrum F-44-4970-4
Synonyms Methyl 3,3-dimethyl-2-(2-propynyl)-4-pentenoate Methyl 3,3-dimethylhept-1-en-6-yne-4-carboxylate
Wiley ID 1176545