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Details of Octacosane, n-

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Role Analyte
nameOctacosane, n-
MPIMP IDA280001
isotopomerambient
formulaC28H58
molecular mass394.761
monoisotopic mass394.45385
InChIInChI=1S/C28H58/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3
InChIKeyZYURHZPYMFLWSH-UHFFFAOYSA-N
substructure TMS0
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,800.02
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27e66be919-93e8-4101-ab46-9612fe796394%27)

Synonyms of Octacosane, n-

propertyvalue
BRENDA57954
CAS630-02-4
ChEBI IDChEBI:32943
ChEBI ontologyis a alkane
ChemSpider ID11902
MetaCycCPD-9765
Method [J Kopka]non-derivatized
PubChem CID12408
PubChem SID92298208
synonymCH3-[CH2]26-CH3
13 synonym(s)

Metabolite mapped to Octacosane, n-

Reference spectra of Octacosane, n-

replicaentry datedetectionmethodspecies
19/1/2001 12:00:00 AM M[2]Standard Addition
22/22/2005 12:00:00 AM M[STR] 
116/27/2008 2:15:31 PM VAR5na
126/27/2008 2:24:36 PM VAR5na
106/23/2008 1:31:01 PM VAR5na
1611/3/2010 4:21:16 PM Schomburg_GC_2010 
35/1/2003 12:00:00 AM M[2]Spathodea campanulata P. Beauv.
411/1/2001 12:00:00 AM M[EIGTMS]Standard Addition
152/3/2011 5:41:17 PM VAR5 
136/27/2008 2:29:25 PM VAR5na
15 spectrum(a)
compound timestamp information
deposited at 7/16/2007 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 8/7/2013 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Strehmel N., Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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