| SpectraBase Spectrum ID |
2zk0KELTv6 |
| Name |
(E)-8-[3-(tert-Butyl)hept-1-en-1-yl]-9-(4-methoxyphenyl)-6-phenyl-9H-purine |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
454.273261730 u |
| Formula |
C29H34N4O |
| InChI |
InChI=1S/C29H34N4O/c1-6-7-13-22(29(2,3)4)14-19-25-32-27-26(21-11-9-8-10-12-21)30-20-31-28(27)33(25)23-15-17-24(34-5)18-16-23/h8-12,14-20,22H,6-7,13H2,1-5H3/b19-14+ |
| InChIKey |
NFTQHQKZJMKTFV-XMHGGMMESA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201709087 |
| Molecular Weight |
454.618 g/mol |
| Quality |
157 |
| Reported Formula |
C29H34N4O |
| SMILES |
C(C)(C)(C)C(CCCC)\C=C\C1=NC=2C(=NC=NC2N1C=1C=CC(=CC1)OC)C1=CC=CC=C1 |
| SPLASH |
splash10-0a4j-1009300000-3bc8ffe037f7c0d055c6 |
| Source of Spectrum |
ACI-56-SM24-4ka (DOI: 10.1002/anie.201709087) |
| Wiley ID |
1896629 |
![(E)-8-[3-(tert-Butyl)hept-1-en-1-yl]-9-(4-methoxyphenyl)-6-phenyl-9H-purine](/api/spectrum/2zk0KELTv6/structure.png?h=300&w=458 "(E)-8-[3-(tert-Butyl)hept-1-en-1-yl]-9-(4-methoxyphenyl)-6-phenyl-9H-purine")
