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经验公式(希尔记法):
13C3C54H104O6
化学文摘社编号:
分子量:
888.41
NACRES:
NA.12
PubChem Substance ID:
UNSPSC Code:
12352200
MDL number:
Isotopic purity:
99 atom % 13C
Assay:
98% (CP)
Mass shift:
M+3
isotopic purity
99 atom % 13C
Quality Segment
assay
98% (CP)
bp
235-240 °C (lit.)
density
0.918 g/mL at 25 °C
mass shift
M+3
storage temp.
−20°C
SMILES string
CCCCCCCC\C=C/CCCCCCCC(=O)O[13CH2][13CH]([13CH2]OC(=O)CCCCCCC\C=C/CCCCCCCC)OC(=O)CCCCCCC\C=C/CCCCCCCC
InChI
1S/C57H104O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h25-30,54H,4-24,31-53H2,1-3H3/b28-25-,29-26-,30-27-/i52+1,53+1,54+1
InChI key
PHYFQTYBJUILEZ-ZMDPPTPPSA-N
Application
This product may be used as an analytical standard.
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.
存储类别
10 - Combustible liquids
wgk
awg
flash_point_f
626.0 °F - closed cup
flash_point_c
330 °C - closed cup