SpectraBase Spectrum ID |
JbgL8uZqCnk |
Name |
Estradiol benzoate, mono-TMS |
Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
Exact Mass |
448.243371551 u |
Formula |
C28H36O3Si |
GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
InChI |
InChI=1S/C28H36O3Si/c1-28-17-16-23-22-13-11-21(30-27(29)19-8-6-5-7-9-19)18-20(22)10-12-24(23)25(28)14-15-26(28)31-32(2,3)4/h5-9,11,13,18,23-26H,10,12,14-17H2,1-4H3 |
InChIKey |
FSFIANRWUMKEGL-UHFFFAOYSA-N |
Molecular Weight |
448.678 g/mol |
Nominal Mass |
448 u |
Number of Peaks |
407 |
SMILES |
c1c(cccc1)C(Oc1ccc2C3CCC4(C(O[Si](C)(C)C)CCC4C3CCc2c1)C)=O |
SPLASH |
splash10-0a4i-2911000000-b23cfa597c1febd24158 |
Source |
Cayman Chemical |
Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
Wiley ID |
VI001826 |