Stearic acid

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Systematic / IUPAC Name: Octadecanoic acid

ID: Reference919

Other Names: n-Octadecanoic acid;
1-Heptadecanecarboxylic acid;
n-Octadecanoic acidd;
Stearophanic acid;
Vanicol ; more

Formula: C18H36O2

Class: Endogenous Metabolites Personal Care Products/Cosmetics Industrial Chemicals

Spectral Data

Stearic 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 Fusion with FAIMS ; Q Exactive Orbitrap
No. of Spectral Trees 4
No. of Spectra 510
Tandem Spectra MS1, MS2
Ionization Methods ESI; NSI
Analyzers FT
Last Modification 6/25/2020 9:23:11 AM
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Identificators

InChI InChI=1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)
InChI Key QIQXTHQIDYTFRH-UHFFFAOYSA-N
Canonical SMILES CCCCCCCCCCCCCCCCCC(=O)O
CAS 57114
Splash
Other Names n-Octadecanoic acid;
1-Heptadecanecarboxylic acid;
n-Octadecanoic acidd;
Stearophanic acid;
Vanicol;
Industrene R;
Glycon DP;
Humko industrene R;
Octadecoic acid;
Hydrofol 1895;
Glycon S-80;
Hydrofol acid 1655;
Tegostearic 254;
Tegostearic 255;
Hystrene 80;
Industrene 5016;
Dar-chem 14;
Emersol 120;
Steric acid;
Prodhygine;
Emersol 153NF;
Prifac 2918;
Unimac 5680;
Bonderlube 235;
Dermarone;
Lunac YA;
Nonsoul SK 1;
Pristerene 4900;
Selosol 920;
Kortacid 1895;
Radiacid 0427;
Edenor ST 20;
Loxiol G 20;
Serfax MT 90;
Century 1210;
Edenor HT-JG 60;
Hydrofol acid 1895

In Other Databases

ChEBI CHEBI:28842
ChemIDPlus 000057114; 000557040; 000557051; 000593293; 000637127; 000643221; 000822162; 002223930; 001592230; 004485125
LipidsMAPs LMFA01010018
ChemSpider 5091
HMDb HMDB00827
ChEMBL CHEMBL46403
Wikipedia Stearic_Acid
PubChem 5281
KEGG C01530; C13961; C13966; D00119; D02184; D02189; D02523; D03310