| SpectraBase Spectrum ID |
3Aj6pPLk36 |
| Name |
2-[(Benzo[1,3]-dioxol-5'-yl)methyl]-3-(piperidin-1'-yl)-2-methylbutane-1,4-diol |
| Alternate Name(s) |
2-(1,3-benzodioxol-5-ylmethyl)-2-methyl-3-(1-piperidinyl)-1,4-butanediol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H27NO4 |
| InChI |
InChI=1S/C18H27NO4/c1-18(12-21,17(11-20)19-7-3-2-4-8-19)10-14-5-6-15-16(9-14)23-13-22-15/h5-6,9,17,20-21H,2-4,7-8,10-13H2,1H3 |
| InChIKey |
OMTPQEATRLNUMT-UHFFFAOYSA-N |
| Molecular Weight |
321.417 g/mol |
| SMILES |
OCC(C(CO)(Cc1cc2OCOc2cc1)C)N1CCCCC1 |
| SPLASH |
splash10-005a-7920000000-46cb44e6a056830fb600 |
| Source of Spectrum |
HE-2004-1496-11 |
| Wiley ID |
1581827 |
![2-[(Benzo[1,3]-dioxol-5'-yl)methyl]-3-(piperidin-1'-yl)-2-methylbutane-1,4-diol](/api/spectrum/3Aj6pPLk36/structure.png?h=300&w=458 "2-[(Benzo[1,3]-dioxol-5'-yl)methyl]-3-(piperidin-1'-yl)-2-methylbutane-1,4-diol")
