| SpectraBase Spectrum ID |
AB50l7hbr2U |
| Name |
1-Methyl-4-(9-phenanthroxy)-1,2,3,6-tetrahydropyridine oxolate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H21NO5 |
| InChI |
InChI=1S/C20H19NO.C2H2O4/c1-21-12-10-16(11-13-21)22-20-14-15-6-2-3-7-17(15)18-8-4-5-9-19(18)20;3-1(4)2(5)6/h2-10,14H,11-13H2,1H3;(H,3,4)(H,5,6) |
| InChIKey |
VBLPRCHKSVMSOD-UHFFFAOYSA-N |
| Molecular Weight |
379.412 g/mol |
| SMILES |
OC(C(=O)O)=O.c1(c2c(cccc2)c2c(c1)cccc2)OC1=CCN(CC1)C |
| SPLASH |
splash10-0002-9010000000-efd8368b0542499a8a29 |
| Source of Spectrum |
E1-37-946-22 |
| Wiley ID |
1574989 |
