| SpectraBase Spectrum ID |
BGA1dhYsXU0 |
| Name |
Methylphenyl calix(4)pyrrole |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C48H44N4 |
| InChI |
InChI=1S/C48H44N4/c1-45(33-17-9-5-10-18-33)37-25-27-39(49-37)46(2,34-19-11-6-12-20-34)41-29-31-43(51-41)48(4,36-23-15-8-16-24-36)44-32-30-42(52-44)47(3,35-21-13-7-14-22-35)40-28-26-38(45)50-40/h5-32,49-52H,1-4H3 |
| InChIKey |
POGOHLQEMDDGLU-UHFFFAOYSA-N |
| Instrument Name |
Micromass Autospec M |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/rcm.1594 |
| Molecular Weight |
676.908 g/mol |
| SMILES |
[nH]1c2C(c3ccc(C(c4ccc(C(c5ccc(C(c1cc2)(C)c1ccccc1)[nH]5)(C)c1ccccc1)[nH]4)(c1ccccc1)C)[nH]3)(c1ccccc1)C |
| SPLASH |
splash10-00b9-0824109000-42c7eb2c1765a1b24dcd |
| Source of Spectrum |
RCM-18-2084-23 |
| Wiley ID |
1836342 |
