SpectraBase Spectrum ID |
8DbiotZIqk9 |
Name |
1-Methyl-4-(4-tert-butylphenoxy)-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 |
C18H25NO5 |
InChI |
InChI=1S/C16H23NO.C2H2O4/c1-16(2,3)13-5-7-14(8-6-13)18-15-9-11-17(4)12-10-15;3-1(4)2(5)6/h5-9H,10-12H2,1-4H3;(H,3,4)(H,5,6) |
InChIKey |
FBOLOXKEDVKSFF-UHFFFAOYSA-N |
Molecular Weight |
335.400 g/mol |
SMILES |
C1=C(Oc2ccc(C(C)(C)C)cc2)CCN(C1)C.OC(C(=O)O)=O |
SPLASH |
splash10-0002-9000000000-f5d153c7e114c41cb68e |
Source of Spectrum |
E1-37-945-19 |
Wiley ID |
1574992 |