| SpectraBase Spectrum ID |
B9In7qo96V0 |
| Name |
2-Aminocaprylic acid, N-benzyloxycarbonyl-, heptyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
391.272258671 u |
| Formula |
C23H37NO4 |
| InChI |
InChI=1S/C23H37NO4/c1-3-5-7-9-14-18-27-22(25)21(17-13-8-6-4-2)24-23(26)28-19-20-15-11-10-12-16-20/h10-12,15-16,21H,3-9,13-14,17-19H2,1-2H3,(H,24,26) |
| InChIKey |
YNVNDWGTZIQOMM-UHFFFAOYSA-N |
| Molecular Weight |
391.552 g/mol |
| SMILES |
C1=CC=CC(=C1)COC(NC(C(OCCCCCCC)=O)CCCCCC)=O |
