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Details of Mannitol (6TMS)

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Role Analyte
nameMannitol (6TMS)
MPIMP IDA193002
isotopomerambient
formulaC24H62O6Si6
molecular mass615.259
monoisotopic mass614.31620
InChIInChI=1S/C24H62O6Si6/c1-31(2,3)25-19-21(27-33(7,8)9)23(29-35(13,14)15)24(30-36(16,17)18)22(28-34(10,11)12)20-26-32(4,5)6/h21-24H,19-20H2,1-18H3/t21-,22-,23-,24-/m1/s1
InChIKeyUSBJDBWAPKNPCK-MOUTVQLLSA-N
substructure TMS6
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,913.17
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2717ebbe6c-f35a-4ae9-bb74-8f669ec70581%27)

Synonyms of Mannitol (6TMS)

Metabolite mapped to Mannitol (6TMS)

metabolitestereoisomerisotopomer
MannitolL- ambient
MannitolD- ambient
MannitolDL- ambient
3 metabolite(s)

Reference spectra of Mannitol (6TMS)

replicaentry datedetectionmethodspecies
2511/3/2010 4:22:12 PM Schomburg_GC_2010 
112/1/2003 12:00:00 AM M[2]Standard
25/12/2005 12:00:00 AM M[NIST] 
35/1/2001 12:00:00 AM M[EIGTMS]Standard Addition
47/1/2001 12:00:00 AM M[2]Standard
51/25/2005 12:00:00 AM M[MOR] 
62/22/2005 12:00:00 AM M[STR] 
711/1/2001 12:00:00 AM M[EIGTMS]Corynebacterium glutamicum
85/12/2005 12:00:00 AM M[NIST] 
97/19/2007 11:16:30 AM VAR5Reference Substance
26 spectrum(a)
    of 3    
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 8/11/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Hummel J.
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