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7-Methoxy-7-oxoheptanoic acid
SpectraBase Compound ID JuM8FDZE0zC
InChI InChI=1S/C8H14O4/c1-12-8(11)6-4-2-3-5-7(9)10/h2-6H2,1H3,(H,9,10)
InChIKey YOLQOHRXBGFZED-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 F75OEqqRRW2
Name 7-Methoxy-7-oxoheptanoic acid
Alternate Name(s) Heptanedioic acid, monomethyl ester Monomethyl pimelate 7-Methoxy-7-oxo-heptanoic acid 7-Methoxy-7-oxidanylidene-heptanoic acid
CAS Registry Number 20291-40-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O4
InChI InChI=1S/C8H14O4/c1-12-8(11)6-4-2-3-5-7(9)10/h2-6H2,1H3,(H,9,10)
InChIKey YOLQOHRXBGFZED-UHFFFAOYSA-N
Molecular Weight 174.196 g/mol
SMILES OC(CCCCCC(OC)=O)=O
SPLASH splash10-0603-9200000000-ce56f654d3e5e87493ef
Source of Spectrum NP-2-6573-0
Wiley ID 1101492