| SpectraBase Spectrum ID |
FSvf6Qj9Q9Q |
| Name |
3-Endo-benzyl-7-hydroxymethyl-6,8-dioxa-3-azabicyclo[3.2.1]octane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
235.120843408 u |
| Formula |
C13H17NO3 |
| InChI |
InChI=1S/C13H17NO3/c15-9-12-11-7-14(8-13(16-11)17-12)6-10-4-2-1-3-5-10/h1-5,11-13,15H,6-9H2 |
| InChIKey |
BCBMIUYLZAHDEW-UHFFFAOYSA-N |
| Molecular Weight |
235.283 g/mol |
| SMILES |
C1N(CC2OC(C1O2)CO)CC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.852314 |
![3-Endo-benzyl-7-hydroxymethyl-6,8-dioxa-3-azabicyclo[3.2.1]octane](/api/spectrum/FSvf6Qj9Q9Q/structure.png?h=300&w=458 "3-Endo-benzyl-7-hydroxymethyl-6,8-dioxa-3-azabicyclo[3.2.1]octane")
