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Suberic acid

View entire compound with spectra: 8 NMR, 8 FTIR, 1 Raman, and 11 MS (GC)

Suberic acid
SpectraBase Compound ID 3F1dr7Hfd8s
InChI InChI=1S/C8H14O4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H,9,10)(H,11,12)
InChIKey TYFQFVWCELRYAO-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 9NkAhUJhjM7
Name Octanedioic acid
CAS Registry Number 505-48-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O4
InChI InChI=1S/C8H14O4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H,9,10)(H,11,12)
InChIKey TYFQFVWCELRYAO-UHFFFAOYSA-N
Molecular Weight 174.196 g/mol
SMILES OC(CCCCCCC(=O)O)=O
SPLASH splash10-07vv-9200000000-c81ca688b7a49ae5bee1
Synonyms Suberic acid 1,6-Dicarboxyhexane 1,6-Hexanedicarboxylic acid 1,8-Octanedioic acid Cork acid Hexamethylenedicarboxylic acid Octane-1,8-dioic acid AI3-52672 EINECS 208-010-9 NSC 25952
Wiley ID 1510311