Thiamine-[13C4].Hydrochloride CAS#: 1257525-77-1

Thiamine-[13C4].Hydrochloride Basic information

Product Name:

Thiamine-[13C4].Hydrochloride

Synonyms:

Thiamine-[13C4].Hydrochloride
Vitamin B1-[13C4] hydrochloride
Aneurine-[13C4] hydrochloride
Thiamine-(4-methyl-13C-thiazol-5-yl-13C3) hydrochloride 99 atom % 13C, 98% (CP)
Thiamine-[13C4].Hydrochloride(Vitamin B1-[13C4])
Vitamin B1 hydrochloride salt
13C4]-Thiamine hydrochloride
Thiamine-(4-methyl-13C-thiazol-5-yl-13C?) hydrochloride

CAS:

1257525-77-1

MF:

C12H18Cl2N4OS

MW:

341.30452

Mol File:

1257525-77-1.mol

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Thiamine-[13C4].Hydrochloride Chemical Properties

Melting point:: 250 °C (dec) (lit.)
storage temp.: -20°C
form: powder
color: white
InChI: InChI=1S/C12H17N4OS.2ClH/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;;/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);2*1H/q+1;;/p-1/i6+1,7+1,10+1,12+1;;
InChIKey: DPJRMOMPQZCRJU-DBRYMKMKSA-M
SMILES: OCCC1=C(C)[N+](=[13CH]S1)[13CH2][13C]1C=NC(=N[13C]=1N)C.[Cl-].[H]Cl

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Thiamine-[13C4].Hydrochloride Usage And Synthesis

Uses

Thiamine-(4-methyl-¹³C-thiazol-5-yl-¹³C₃) hydrochloride is also known as vitamin B₁(4-methyl-¹³C-thiazol-5-yl-¹³C₃) hydrochloride. It can be used as a stable isotope internal standard for accurate data interpretation in specific biological samples by mass spectrometry (MS).

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