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Merck
CN

731188

Thiamine-(4-methyl-13C-thiazol-5-yl-13C3) hydrochloride

99 atom % 13C, 98% (CP)

Synonym(s):

Vitamin B1(4-methyl-13C-thiazol-5-yl-13C3) hydrochloride

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About This Item

Empirical Formula (Hill Notation):
13C4C8H17ClN4OS · HCl
CAS Number:
1257525-77-1
Molecular Weight:
341.24
NACRES:
NA.24
PubChem Substance ID:
329764629
UNSPSC Code:
12352116
MDL number:
MFCD17015237
Isotopic purity:
99 atom % 13C
Assay:
98% (CP)
Mass shift:
M+4
Form:
powder

Key Documents

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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/i1+1,7+1,8+1,11+1;;

SMILES string

Cl.[Cl-].Cc1ncc(C[n+]2[13cH]s[13c](CCO)[13c]2[13CH3])c(N)n1

InChI key

DPJRMOMPQZCRJU-VJFONHOHSA-M

isotopic purity

99 atom % 13C

assay

98% (CP)

form

powder

technique(s)

mass spectrometry (MS): suitable

color

white

mp

250 °C (dec) (lit.)

mass shift

M+4

storage temp.

−20°C

Quality Level

200

Related Categories

Application

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).

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

pictograms

Exclamation mark
GHS07

signalword

Warning

hcodes

H319

Hazard Classifications

Eye Irrit. 2

Storage Class

11 - Combustible Solids

wgk

WGK 1

flash_point_f

Not applicable

flash_point_c

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
MBBF1786
MBBF1469
MBBF1026
MBBF0628
MBBF0096

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Rohiverth Guarecuco et al.
Science advances, 6(41) (2020-10-11)
Tumor environment influences anticancer therapy response but which extracellular nutrients affect drug sensitivity is largely unknown. Using functional genomics, we determine modifiers of l-asparaginase (ASNase) response and identify thiamine pyrophosphate kinase 1 as a metabolic dependency under ASNase treatment. While

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