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ETA(6)-[CF3C-[N-2,6-(I)PR2C6H3]-NH-(2,6-(I)PR2C6H3)]-MO(CO)3
SpectraBase Compound ID CT97yYoBYya
InChI InChI=1S/C26H35F3N2.3CO.Mo/c1-15(2)19-11-9-12-20(16(3)4)23(19)30-25(26(27,28)29)31-24-21(17(5)6)13-10-14-22(24)18(7)8;3*1-2;/h9-18H,1-8H3,(H,30,31);;;;
InChIKey PCXPKRKOYUTZNQ-UHFFFAOYSA-N
Mol Weight 612.6 g/mol
Molecular Formula C29H35F3MoN2O3
Exact Mass 614.165381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5YijZze6lzM
Name Tricarbonyl-{N,N'-bis(2',6'-diisopropylphenyl)trifluoroacetamidine}-molybdenium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H35F3MoN2O3
InChI InChI=1S/C26H35F3N2.3CO.Mo/c1-15(2)19-11-9-12-20(16(3)4)23(19)30-25(26(27,28)29)31-24-21(17(5)6)13-10-14-22(24)18(7)8;3*1-2;/h9-18H,1-8H3,(H,30,31);;;;
InChIKey PCXPKRKOYUTZNQ-UHFFFAOYSA-N
Molecular Weight 612.556 g/mol
SMILES [Mo].N(c1c(C(C)C)cccc1C(C)C)\C(=N/c1c(C(C)C)cccc1C(C)C)C(F)(F)F.[O+]#[C-].[O+]#[C-].[O+]#[C-]
SPLASH splash10-053r-0465392000-8ecaee9eb3ea7d2ef97e
Source of Spectrum I-78-589-3
Wiley ID 812625