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Details of Pentacosane, n-

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Role Analyte
namePentacosane, n-
MPIMP IDA250004
isotopomerambient
formulaC25H52
molecular mass352.681
monoisotopic mass352.40690
InChIInChI=1S/C25H52/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2/h3-25H2,1-2H3
InChIKeyYKNWIILGEFFOPE-UHFFFAOYSA-N
substructure TMS0
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,499.33
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%273d3deece-5ca1-4074-93aa-8b14d95f8452%27)

Synonyms of Pentacosane, n-

propertyvalue
CAS629-99-2
ChEBI IDChEBI:32938
ChEBI ontologyis a alkane
ChemSpider ID11900
MetaCycCPD-7944
PubChem CID12406
PubChem SID92298305
synonymCH3-[CH2]23-CH3
synonymn-pentacosane
synonympentacosane
11 synonym(s)
    of 2    

Metabolite mapped to Pentacosane, n-

Reference spectra of Pentacosane, n-

replicaentry datedetectionmethodspecies
15/12/2005 12:00:00 AM M[NIST] 
21/25/2005 12:00:00 AM M[MOR] 
35/1/2003 12:00:00 AM M[2]Spathodea campanulata P. Beauv.
3 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.
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