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Thiopental
SpectraBase Compound ID 51aIQwMukWZ
InChI InChI=1S/C11H18N2O2S/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)
InChIKey IUJDSEJGGMCXSG-UHFFFAOYSA-N
Mol Weight 242.34 g/mol
Molecular Formula C11H18N2O2S
Exact Mass 242.108899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2L4wW54Mpc3
Name Thiopental
Alternate Name(s) Pentothal (RS)-[5-ethyl-4,6-dioxo-5-(pentan-2-yl)-1,4,5,6-tetrahydropyrimidin-2-yl]sulfanide 5-Ethyl-5-(pentan-2-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
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Formula C11H18N2O2S
InChI InChI=1S/C11H18N2O2S/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)
InChIKey IUJDSEJGGMCXSG-UHFFFAOYSA-N
Molecular Weight 242.337 g/mol
SMILES N1C(NC(C(C(CCC)C)(CC)C1=O)=O)=S
SPLASH splash10-05fu-7900000000-452ad2289178260a82ed
Source of Spectrum SWG-33-3039-0
Wiley ID 1810006