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经验公式(希尔记法):
C18D4H17NaO5S
化学文摘社编号:
分子量:
376.44
NACRES:
NA.12
PubChem Substance ID:
UNSPSC Code:
12352211
MDL number:
Isotopic purity:
≥95 atom % D
Assay:
≥99% (CP)
Mass shift:
M+4
InChI
1S/C18H22O5S.Na/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19;/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22);/q;+1/p-1/t14-,15-,16+,18+;/m1./s1/i3D,7D2,10D;
SMILES string
[Na+].[2H]c1cc2[C@H]3CC[C@@]4(C)[C@@H](CC([2H])([2H])C4=O)[C@@H]3CCc2c([2H])c1OS([O-])(=O)=O
InChI key
VUCAHVBMSFIGAI-IGBMKMNFSA-M
isotopic purity
≥95 atom % D
assay
≥99% (CP)
contains
35% TRIS-d5 as stabilizer
technique(s)
mass spectrometry (MS): suitable
mp
300 °C (lit.)
mass shift
M+4
storage temp.
−20°C
Quality Level
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.
signalword
Danger
hcodes
Hazard Classifications
Carc. 1B - Eye Irrit. 2 - Repr. 1B - Skin Irrit. 2 - STOT SE 3
存储类别
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
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