SpectraBase Spectrum ID |
9b833B1KFfA |
Name |
Pentacarbonyl[(1R,2S,5R)-(-)-8-phenylmenthyloxybenzylidene]chromium(0) |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
512.129093616 u |
Formula |
C28H28CrO6 |
InChI |
InChI=1S/C23H28O.5CO.Cr/c1-18-14-15-21(23(2,3)20-12-8-5-9-13-20)22(16-18)24-17-19-10-6-4-7-11-19;5*1-2;/h4-13,18,21-22H,14-16H2,1-3H3;;;;;;/t18-,21-,22-;;;;;;/m1....../s1 |
InChIKey |
SFLOKBGSCSNFPG-MXFBPKMESA-N |
Molecular Weight |
512.522 g/mol |
SMILES |
C(=[Cr](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(O[C@]1([C@](C(C2=CC=CC=C2)(C)C)(CC[C@](C1)(C)[H])[H])[H])C1=CC=CC=C1 |