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1,7-HEPTANEDICARBOXYLIC-ACID

View entire compound with spectra: 8 NMR, 6 FTIR, 1 Raman, and 4 MS (GC)

1,7-HEPTANEDICARBOXYLIC-ACID
SpectraBase Compound ID BLKjK3sQEWI
InChI InChI=1S/C9H16O4/c10-8(11)6-4-2-1-3-5-7-9(12)13/h1-7H2,(H,10,11)(H,12,13)
InChIKey BDJRBEYXGGNYIS-UHFFFAOYSA-N
Mol Weight 188.22 g/mol
Molecular Formula C9H16O4
Exact Mass 188.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8SkZZrWBqqh
Name Azelaic acid
Alternate Name(s) Nonanedioic acid 1,7-Dicarboxyheptane 1,7-Heptanedicarboxylic acid 1,9-Nonanedioic acid Acide azelaique Acido azelaico Anchoic acid Azelaic acid, technical grade Azelainic acid Azelex Emery's L-110 Finacea Heptanedicarboxylic acid Lepargylic acid n-Nonanedioic acid Skinoren AI3-06299 BRN 1101094 EINECS 204-669-1 EMEROX 1110 Emerox 1144 NSC 19493 ZK 62498
CAS Registry Number 123-99-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O4
InChI InChI=1S/C9H16O4/c10-8(11)6-4-2-1-3-5-7-9(12)13/h1-7H2,(H,10,11)(H,12,13)
InChIKey BDJRBEYXGGNYIS-UHFFFAOYSA-N
Molecular Weight 188.223 g/mol
SMILES OC(CCCCCCCC(=O)O)=O
SPLASH splash10-06rx-9100000000-3cba2af8f9162d616fa0
Source of Spectrum JC-408-151-7
Wiley ID 1184343