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Heptanoic acid ethyl ester
SpectraBase Compound ID bHtmpk0nHq
InChI InChI=1S/C9H18O2/c1-3-5-6-7-8-9(10)11-4-2/h3-8H2,1-2H3
InChIKey TVQGDYNRXLTQAP-UHFFFAOYSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H18O2
Exact Mass 158.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LjgmRU94j8K
Name Heptanoic acid, ethyl ester
CAS Registry Number 106-30-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-3-5-6-7-8-9(10)11-4-2/h3-8H2,1-2H3
InChIKey TVQGDYNRXLTQAP-UHFFFAOYSA-N
Molecular Weight 158.241 g/mol
SMILES CCCCCCC(=O)OCC
SPLASH splash10-01pc-9100000000-77d19ff4c76e8cdadba7
Source of Spectrum JZ-1992-3733-0
Synonyms Heptanoic acid ethyl ester Aether oenanthicus Cognac oil Enanthic acid ethyl ester Enanthylic ether Ethyl enantate Ethyl enanthate Ethyl ester of heptanoic acid Ethyl heptanoate Ethyl heptoate Ethyl heptylate Ethyl n-heptanoate Ethyl oenanthate Ethyl oenanthylate Grape oil Oenanthic ether Oleum vitis viniferae Wine oil AI3-24251 BRN 1752311 CCRIS 1344 EINECS 203-382-9 FEMA NO. 2437 NSC 8891
Wiley ID 1155407