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(Sa,4S,5S)-Iodo(eta-4-1,5-norbornadiene)(1-phenyl-4-(2,2-di-methyl-4-phenyl-1,3-dioxan-5-yl)-4,5-dihydro-1H-1,2,4-triazol-5-ylidene)rhodium(I)
SpectraBase Compound ID DEJCa9jF8fZ
InChI InChI=1S/C20H21N3O2.C7H8.HI.Rh/c1-20(2)24-13-18(19(25-20)16-9-5-3-6-10-16)22-14-21-23(15-22)17-11-7-4-8-12-17;1-2-7-4-3-6(1)5-7;;/h3-12,14,18-19H,13H2,1-2H3;1-4,6-7H,5H2;1H;/q;;;+1/p-1/t18-,19-;6-,7+;;/m0.../s1
InChIKey MPQGOYFPSSNURB-KGJNNEAWSA-M
Mol Weight 658.37 g/mol
Molecular Formula C27H30IN3O2Rh
Exact Mass 658.043762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYXaugwxbnh
Name (Sa,4S,5S)-Iodo(eta-4-1,5-norbornadiene)(1-phenyl-4-(2,2-di-methyl-4-phenyl-1,3-dioxan-5-yl)-4,5-dihydro-1H-1,2,4-triazol-5-ylidene)rhodium(I)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H29IN3O2Rh
InChI InChI=1S/C20H21N3O2.C7H8.HI.Rh/c1-20(2)24-13-18(19(25-20)16-9-5-3-6-10-16)22-14-21-23(15-22)17-11-7-4-8-12-17;1-2-7-4-3-6(1)5-7;;/h3-12,14,18-19H,13H2,1-2H3;1-4,6-7H,5H2;1H;/q;;;+1/p-1/t18-,19-;6-,7+;;/m0.../s1
InChIKey MPQGOYFPSSNURB-KGJNNEAWSA-M
Molecular Weight 658.366 g/mol
SMILES C=1[C@]2(C[C@@](C1)(C=C2)[H])[H].[I-].[Rh+].[CH]1N(N=CN1[C@@]1([C@](c2ccccc2)(OC(C)(C)OC1)[H])[H])c1ccccc1
SPLASH splash10-0019-0001980000-b62b7528e40e2eea50bd
Source of Spectrum U2-1998-919-8b
Wiley ID 1790728