[15N,tris(13C)]-pantothenic acid - tris(trimethylsilyl) derivative - Optional[MS (GC)] - Spectrum

SpectraBase Compound ID	Lak3bDv3Bch
InChI	InChI=1S/C18H41NO5Si3/c1-18(2,14-22-25(3,4)5)16(24-27(9,10)11)17(21)19-13-12-15(20)23-26(6,7)8/h16H,12-14H2,1-11H3,(H,19,21)/t16-/m0/s1/i12+1,13+1,15+1,19+1
InChIKey	PQFJBMOEKCYOJR-SADKPACZSA-N Google Search
Mol Weight	439.8 g/mol
Molecular Formula	C1513C3H4115NO5Si3
Exact Mass	439.236352 g/mol

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SpectraBase Spectrum ID	BthgUehnYFd
Name	[15N,tris(13C)]-pantothenic acid - tris(trimethylsilyl) derivative
Comments	Original formula: C15[13C]3H41[15N]O5Si3
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Formula	C18H41NO5Si3
InChI	InChI=1S/C18H41NO5Si3/c1-18(2,14-22-25(3,4)5)16(24-27(9,10)11)17(21)19-13-12-15(20)23-26(6,7)8/h16H,12-14H2,1-11H3,(H,19,21)/t16-/m0/s1/i12+1,13+1,15+1,19+1
InChIKey	PQFJBMOEKCYOJR-SADKPACZSA-N
Molecular Weight	439.753 g/mol
SMILES	[13CH2]([13CH2][13C](O[Si](C)(C)C)=O)[15NH]C([C@@](C(CO[Si](C)(C)C)(C)C)(O[Si](C)(C)C)[H])=O
SPLASH	splash10-0592-3950000000-a5d99da18a4413f875f1
Source of Spectrum	O-36-558-0
Synonyms	[¹5N,tris(¹³C)]-N-[2',4'-bis(Trimethylsilyloxy)-3',3'-dimethylbutyryl)-.beta.-(trimethylsilyl)alanine
Wiley ID	848719