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YAKJJLIGBXFPHB-UHFFFAOYSA-M

View entire compound with spectra: 2 NMR

YAKJJLIGBXFPHB-UHFFFAOYSA-M
SpectraBase Compound ID LmoPZ4TmNEN
InChI InChI=1S/C31H28N4O2P.BrH/c36-30-28-29(31(37)35(30)24-14-5-1-6-15-24)34(33-32-28)22-13-23-38(25-16-7-2-8-17-25,26-18-9-3-10-19-26)27-20-11-4-12-21-27;/h1-12,14-21,28-29H,13,22-23H2;1H/q+1;/p-1
InChIKey YAKJJLIGBXFPHB-UHFFFAOYSA-M
Mol Weight 599.47 g/mol
Molecular Formula C31H28BrN4O2P
Exact Mass 598.113326 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HScQxCXS1JA
Name YAKJJLIGBXFPHB-UHFFFAOYSA-M
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H28BrN4O2P
InChI InChI=1S/C31H28N4O2P.BrH/c36-30-28-29(31(37)35(30)24-14-5-1-6-15-24)34(33-32-28)22-13-23-38(25-16-7-2-8-17-25,26-18-9-3-10-19-26)27-20-11-4-12-21-27;/h1-12,14-21,28-29H,13,22-23H2;1H/q+1;/p-1
InChIKey YAKJJLIGBXFPHB-UHFFFAOYSA-M
Literature Reference Author A.L.CHHEN,M.SOUFIAOUI,R.CARRIE
Literature Reference Citation BULL.SOC.CHIM.FR.,129,308(1992)
Molecular Weight 599.467 g/mol
Solvent CD3CN
Source File Reference UWSK2319