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Details of Butane, n-

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Role	Analyte
name	Butane, n-
MPIMP ID	A000420
isotopomer	ambient
formula	C4H10
molecular mass	58.122
monoisotopic mass	58.07825
InChI	InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3
InChIKey	IJDNQMDRQITEOD-UHFFFAOYSA-N
substructure TMS	0
substructure TBS	0
substructure H3ON	0
substructure CH3O	0
retention index (VAR5 method, n-alkanes C10–C36)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2725903e76-2345-41a4-bcbb-f5baef0fb718%27)

Synonyms of Butane, n-

property	value
CAS	106-97-8
ChemSpider ID	7555
synonym	Butane
synonym	n-Butane
4 synonym(s)

Metabolite mapped to Butane, n-

metabolite	stereoisomer	isotopomer
Butane	n-	ambient
1 metabolite(s)

Reference spectra of Butane, n-

replica	entry date	detection	method	species
1	5/12/2005 12:00:00 AM		M[NIST]
1 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 10/1/2012 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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