WCTVOCDBSMJOPH-UHFFFAOYSA-M
Compound with spectra: 1 NMR
| SpectraBase Compound ID | EHCE54Xb3Jb |
|---|---|
| InChI | InChI=1S/C28H28N7.BrH/c29-27-26-28(31-19-30-27)35(20-32-26)18-22-5-9-24(10-6-22)23-7-3-21(4-8-23)17-33-15-11-25(12-16-33)34-13-1-2-14-34;/h3-12,15-16,19-20H,1-2,13-14,17-18H2,(H2,29,30,31);1H/q+1;/p-1 |
| InChIKey | WCTVOCDBSMJOPH-UHFFFAOYSA-M |
| Mol Weight | 542.49 g/mol |
| Molecular Formula | C28H28BrN7 |
| Exact Mass | 541.158957 g/mol |
| Parent InChIKey | IURGSLJXWFCKLO-UHFFFAOYSA-M |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
CBNIFFRLHIYNSS-UHFFFAOYSA-M
RQAQZFVEHFZSMG-UHFFFAOYSA-M
SMEWLRZMVWWJET-UHFFFAOYSA-M
WWMAGXLKJVQCHA-UHFFFAOYSA-M
6-AMINO-9-(2-CHLOROBENZYL)-PURINE
(9-benzyl-2-chloro-purin-6-yl)amine
6-Butyl-9-(phenylmethyl)purine
(E)-9-BENZYL-6-[2-(DIMETHYLAMINO)-VINYL]-PURINE
9-BENZYL-6-[2-(METHYLAMINO)-ETHYL]-PURINE
9-BENZYL-6-[2-(METHYLSULFANYL)-ETHYL]-PURINE
| Title | Journal or Book | Year |
|---|---|---|
| 1 H and 13 C NMR spectral assignments of pyridinium salts linked to a N -9 or N -3 adenine moiety | Magnetic Resonance in Chemistry | 2012 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.