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PROPIONIC ACID, HEPTYL ESTER
SpectraBase Compound ID MGVSlVxXOG
InChI InChI=1S/C10H20O2/c1-3-5-6-7-8-9-12-10(11)4-2/h3-9H2,1-2H3
InChIKey BGYICJVBGZQOCY-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8H5zpifSKgK
Name Heptylpropionate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 172.146329882 u
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-3-5-6-7-8-9-12-10(11)4-2/h3-9H2,1-2H3
InChIKey BGYICJVBGZQOCY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 172.268 g/mol
Nominal Mass 172 u
Quality 1000
Retention Index 1190
SMILES C(OCCCCCCC)(CC)=O
SPLASH splash10-0a4i-9000000000-f8a5a61f9a76765ff7f0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms heptyl propanoate
Technique GC/MS
Wiley ID DD2024_025756