4-Hydroxycyclohexylacetic acid

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Systematic / IUPAC Name: 2-(4-Hydroxycyclohexyl)acetic acid

ID: Reference14088

Other Names: cis-4-Hydroxycyclohexylacetic acid;
AA-2736

Formula: C8H14O3

Class: Endogenous Metabolites

Spectral Data

4-Hydroxycyclohexylacetic 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 Orbitrap ID-X with ETD_Cal Gateshead
No. of Spectral Trees 1
No. of Spectra 264
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 10/21/2026 11:13:29 AM
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Identificators

InChI InChI=1S/C8H14O3/c9-7-3-1-6(2-4-7)5-8(10)11/h6-7,9H,1-5H2,(H,10,11)
InChI Key ALTAAUJNHYWOGS-UHFFFAOYSA-N
Canonical SMILES O=C(O)CC1CCC(O)CC1
CAS
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Other Names cis-4-Hydroxycyclohexylacetic acid;
AA-2736

In Other Databases

ChEBI CHEBI:89344
HMDb HMDB0000451; HMDB0000451; HMDB00451
ChemSpider 13628091
PubChem 12702257