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Details of Phenylalanine (1TMS)

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Role Analyte
namePhenylalanine (1TMS)
MPIMP IDA157001
isotopomerambient
formulaC12H19NO2Si
molecular mass237.371
monoisotopic mass237.11851
InChIInChI=1S/C12H19NO2Si/c1-16(2,3)15-12(14)11(13)9-10-7-5-4-6-8-10/h4-8,11H,9,13H2,1-3H3/t11-/m0/s1
InChIKeyNBXFAHHUVWSAFQ-NSHDSACASA-N
substructure TMS1
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,556.05
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%272efd042c-f627-49c8-8bbf-1a214fb9a784%27)

Synonyms of Phenylalanine (1TMS)

Metabolite mapped to Phenylalanine (1TMS)

metabolitestereoisomerisotopomer
PhenylalanineL- ambient
PhenylalanineDL- ambient
2 metabolite(s)

Reference spectra of Phenylalanine (1TMS)

replicaentry datedetectionmethodspecies
103/30/2011 4:52:37 PM Fiehn_GC_2010 
911/3/2010 4:22:31 PM Schomburg_GC_2010 
15/1/2001 12:00:00 AM M[EIGTMS]Standard
22/22/2005 12:00:00 AM M[STR] 
35/12/2005 12:00:00 AM M[NIST] 
43/15/2005 12:00:00 AM M[6]Reference Substance
511/1/2001 12:00:00 AM M[EIGTMS]Corynebacterium glutamicum
113/30/2011 4:52:37 PM Fiehn_GC_2010 
62/22/2005 12:00:00 AM M[STR] 
77/19/2007 11:16:30 AM VAR5Reference Substance
12 spectrum(a)
    of 2    
compound timestamp information
deposited at 7/20/2007 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 8/9/2011 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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