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InChI
1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1/i9D,13D2,17D2,21D
SMILES string
[2H]C1=C2C([2H])([2H])[C@@]([2H])(O)C([2H])([2H])C[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3C1)[C@H](C)CCCC(C)C
InChI key
HVYWMOMLDIMFJA-HHPLMCQASA-N
isotopic purity
97 atom % D
assay
98% (CP)
optical activity
[α]20/D -40°, c = 2 in chloroform
technique(s)
mass spectrometry (MS): suitable
bp
360 °C (lit.)
mp
147-149 °C (lit.)
density
1.088 g/mL at 25 °C
mass shift
M+6
storage temp.
−20°C
Quality Level
Related Categories
1 of 4
This Item | 749478 | 709549 | 723266 |
|---|---|---|---|
| assay 98% (CP) | assay 98% (CP) | assay 98% (CP) | assay 98% (CP) |
| technique(s) mass spectrometry (MS): suitable | technique(s) mass spectrometry (MS): suitable | technique(s) mass spectrometry (MS): suitable | technique(s) mass spectrometry (MS): suitable |
| isotopic purity 97 atom % D | isotopic purity 99 atom % 13C | isotopic purity 97 atom % D | isotopic purity 97 atom % D |
| mass shift M+6 | mass shift M+3 | mass shift M+6 | mass shift M+6 |
| Quality Level 200 | Quality Level 200 | Quality Level 200 | Quality Level 200 |
| bp 360 °C (lit.) | bp - | bp - | bp - |
Packaging
Storage Class
11 - Combustible Solids
wgk
WGK 1
flash_point_f
Not applicable
flash_point_c
Not applicable
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