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4-Pentenoic acid, 2-acetyl-, ethyl ester
SpectraBase Compound ID 2AVkKWH3yhL
InChI InChI=1S/C9H14O3/c1-4-6-8(7(3)10)9(11)12-5-2/h4,8H,1,5-6H2,2-3H3
InChIKey IXKFNTFJUHTDNE-UHFFFAOYSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 735K9tgaR6B
Name 4-Pentenoic acid, 2-acetyl-, ethyl ester
CAS Registry Number 610-89-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-4-6-8(7(3)10)9(11)12-5-2/h4,8H,1,5-6H2,2-3H3
InChIKey IXKFNTFJUHTDNE-UHFFFAOYSA-N
Molecular Weight 170.208 g/mol
SMILES C(C(=O)OCC)(C(=O)C)CC=C
SPLASH splash10-0a6r-0900000000-1efc56fd8f15cd0ff2d2
Source of Spectrum F-50-13693-4
Synonyms 2-Acetyl-4-pentenoic acid ethyl ester Ethyl 2-acetyl-4-pentenoate 2-Acetylpent-4-enoic acid ethyl ester Ethyl .alpha.-allylacetoacetate Ethyl 2-acetylpent-4-enoate Ethyl 2-allylacetoacetate Ethyl 2-ethanoylpent-4-enoate AI3-11071 EINECS 210-237-3 NSC 10814
Wiley ID 790296