Adipic acid

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Systematic / IUPAC Name: Hexanedioic acid

ID: Reference642

Other Names: 1,4-Butanedicarboxylic acid;
1,6-Hexanedioic acid;
Adipinic acid;
Acifloctin;
Adilactetten

Formula: C6H10O4

Class: Industrial Chemicals Excipients/Additives/Colorants

Spectral Data

Adipic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 185
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/12/2016 7:09:26 AM
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Identificators

InChI InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)
InChI Key WNLRTRBMVRJNCN-UHFFFAOYSA-N
Canonical SMILES C(CCC(=O)O)CC(=O)O
CAS 124049
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Other Names 1,4-Butanedicarboxylic acid;
1,6-Hexanedioic acid;
Adipinic acid;
Acifloctin;
Adilactetten

In Other Databases

ChEMBL CHEMBL1157
ChemIDPlus 000142881; 007486386; 007486397; 015511816; 016031837; 019628285; 019628296; 000124049; 031699726; 031699748
LipidsMAPs LMFA01170048
PubChem 196
Wikipedia Adipic acid
ChEBI CHEBI:30832
HMDb HMDB00448
ChemSpider 191
KEGG C06104; D02145; D08839