| SpectraBase Spectrum ID |
7igQOQMYQmW |
| Name |
3-(Adamantylmethyl)-5-(hydroxyphenyl)-2-(4-hydroxyphenylacetamido)pyrazine |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H31N3O3 |
| InChI |
InChI=1S/C29H31N3O3/c33-22-7-5-18(6-8-22)12-27(35)32-28-24(31-25(17-30-28)23-3-1-2-4-26(23)34)16-29-13-19-9-20(14-29)11-21(10-19)15-29/h1-8,17,19-21,33-34H,9-16H2,(H,30,32,35)/t19-,20+,21-,29- |
| InChIKey |
NVIUZCZRBKJSMW-HNXVDQRVSA-N |
| Molecular Weight |
469.585 g/mol |
| SMILES |
N(c1c(nc(-c2c(cccc2)O)cn1)CC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(Cc1ccc(cc1)O)=O |
| SPLASH |
splash10-000i-0009300000-7e0003ce93c71c25842f |
| Source of Spectrum |
F-53-12915-6 |
| Synonyms |
N-[3-(1-adamantylmethyl)-5-(2-hydroxyphenyl)-2-pyrazinyl]-2-(4-hydroxyphenyl)acetamide |
| Wiley ID |
803788 |
