| SpectraBase Compound ID | IIbjqYEb2CV |
|---|---|
| InChI | InChI=1S/C13H21NO.C2H2O4/c1-2-3-5-10-12(14)13(15)11-8-6-4-7-9-11;3-1(4)2(5)6/h4,6-9,12-13,15H,2-3,5,10,14H2,1H3;(H,3,4)(H,5,6) |
| InChIKey | YUJSEUBSSUOTOI-UHFFFAOYSA-N |
| Mol Weight | 297.35 g/mol |
| Molecular Formula | C15H23NO5 |
| Exact Mass | 297.157623 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7PhDclKhFyU |
|---|---|
| Name | 2-Amino-1-phenyl-1-heptanol, oxalate (1:1) (salt) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.157622840 u |
| Formula | C15H23NO5 |
| InChI | InChI=1S/C13H21NO.C2H2O4/c1-2-3-5-10-12(14)13(15)11-8-6-4-7-9-11;3-1(4)2(5)6/h4,6-9,12-13,15H,2-3,5,10,14H2,1H3;(H,3,4)(H,5,6) |
| InChIKey | YUJSEUBSSUOTOI-UHFFFAOYSA-N |
| SMILES | OC(C(CCCCC)N)C1=CC=CC=C1.OC(C(=O)O)=O |