| SpectraBase Spectrum ID |
6tjL1XXKcoo |
| Name |
2-[(1S)-1-(3-aminophenyl)propyl]-5-hydroxy-3-keto-5-propyl-caprylic acid methyl ester |
| Alternate Name(s) |
2-[(1S)-1-(3-aminophenyl)propyl]-5-hydroxy-3-oxo-5-propyloctanoic acid methyl ester
Methyl 2-[(1S)-1-(3-aminophenyl)propyl]-5-hydroxy-3-oxo-5-propyl-octanoate
Methyl 2-[(1S)-1-(3-aminophenyl)propyl]-5-oxidanyl-3-oxidanylidene-5-propyl-octanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H33NO4 |
| InChI |
InChI=1S/C21H33NO4/c1-5-11-21(25,12-6-2)14-18(23)19(20(24)26-4)17(7-3)15-9-8-10-16(22)13-15/h8-10,13,17,19,25H,5-7,11-12,14,22H2,1-4H3/t17-,19?/m1/s1 |
| InChIKey |
PNXNBZOCVISCGK-DUSLRRAJSA-N |
| Molecular Weight |
363.498 g/mol |
| SMILES |
OC(CC(C([C@@](c1cc(ccc1)N)(CC)[H])C(=O)OC)=O)(CCC)CCC |
| SPLASH |
splash10-0229-0395000000-ce97cd080ad3e86964b7 |
| Source of Spectrum |
J-64-4984-21 |
| Wiley ID |
1530553 |
![2-[(1S)-1-(3-aminophenyl)propyl]-5-hydroxy-3-keto-5-propyl-caprylic acid methyl ester](/api/spectrum/6tjL1XXKcoo/structure.png?h=300&w=458 "2-[(1S)-1-(3-aminophenyl)propyl]-5-hydroxy-3-keto-5-propyl-caprylic acid methyl ester")
