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3-PROPYLGLUTARIC ACID
SpectraBase Compound ID FQOKkGug2j4
InChI InChI=1S/C8H14O4/c1-2-3-6(4-7(9)10)5-8(11)12/h6H,2-5H2,1H3,(H,9,10)(H,11,12)
InChIKey YHJZYPZZBZPIPX-UHFFFAOYSA-N
Mol Weight 174.2 g/mol
Molecular Formula C8H14O4
Exact Mass 174.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HeezX5ehaqB
Name 3-Propylpentanedioic acid
CAS Registry Number 4165-98-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O4
InChI InChI=1S/C8H14O4/c1-2-3-6(4-7(9)10)5-8(11)12/h6H,2-5H2,1H3,(H,9,10)(H,11,12)
InChIKey YHJZYPZZBZPIPX-UHFFFAOYSA-N
Molecular Weight 174.196 g/mol
SMILES OC(CC(CC(=O)O)CCC)=O
SPLASH splash10-0007-9000000000-e8bc0f74f4885f70b94d
Source of Spectrum NP-2-6576-0
Synonyms .beta.-n-Propylglutaric acid 3-n-Propylglutaric acid 3-Propylglutaric acid Pentanedioic acid, 3-propyl-
Wiley ID 1101496