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Pentacarbonyl{ 4-[2.2]metacyclophanyl-[E-(R)-2'-butylamino)carbene} chromium (0)
SpectraBase Compound ID 9gXROW2201D
InChI InChI=1S/C21H25N.5CO.Cr/c1-3-16(2)22-15-21-14-19-8-4-6-17(12-19)10-11-18-7-5-9-20(21)13-18;5*1-2;/h4-9,12-13,16,21-22H,3,10-11,14H2,1-2H3;;;;;;/t16-,21?;;;;;;/m1....../s1
InChIKey CBHMKVLWJQBJEL-ISIBEMEBSA-N
Mol Weight 483.48 g/mol
Molecular Formula C26H25CrNO5
Exact Mass 483.113778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4AUnYQ4WchW
Name Pentacarbonyl{ 4-[2.2]metacyclophanyl-[E-(R)-2'-butylamino)carbene} chromium (0)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H25CrNO5
InChI InChI=1S/C21H25N.5CO.Cr/c1-3-16(2)22-15-21-14-19-8-4-6-17(12-19)10-11-18-7-5-9-20(21)13-18;5*1-2;/h4-9,12-13,16,21-22H,3,10-11,14H2,1-2H3;;;;;;/t16-,21?;;;;;;/m1....../s1
InChIKey CBHMKVLWJQBJEL-ISIBEMEBSA-N
Molecular Weight 483.484 g/mol
SMILES N(C(=[Cr](C#[O])(C#[O])(C#[O])(C#[O])C#[O])C1c2cc(CCc3cc(C1)ccc3)ccc2)[C@@](CC)(C)[H]
SPLASH splash10-0006-0009100000-02d5830de245ec962a7f
Source of Spectrum K-130-1110-12
Wiley ID 1395820