| SpectraBase Spectrum ID |
3im5KdG8hmj |
| Name |
Oxalate salt of 1-methyl-4-(3-chlorophenoxy)-1,2,3,6-tetrahydropyridine |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H16ClNO5 |
| InChI |
InChI=1S/C12H14ClNO.C2H2O4/c1-14-7-5-11(6-8-14)15-12-4-2-3-10(13)9-12;3-1(4)2(5)6/h2-5,9H,6-8H2,1H3;(H,3,4)(H,5,6) |
| InChIKey |
JIJZJLNGFKKYHX-UHFFFAOYSA-N |
| Molecular Weight |
313.737 g/mol |
| SMILES |
C1=C(Oc2cc(Cl)ccc2)CCN(C1)C.OC(C(=O)O)=O |
| SPLASH |
splash10-0002-9000000000-3b8fa386d1333d006270 |
| Source of Spectrum |
E1-38-1906-14 |
| Wiley ID |
1598310 |
