| SpectraBase Spectrum ID |
VuLd20u1PB |
| Name |
N-Tert-butoxycarbonyl-7-fluor-3-aza-9-oxatricyclo[5.3.0.01,5]decan-8-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
271.121986223 u |
| Formula |
C13H18FNO4 |
| InChI |
InChI=1S/C13H18FNO4/c1-11(2,3)19-10(17)15-5-8-4-13(14)9(16)18-7-12(8,13)6-15/h8H,4-7H2,1-3H3/t8-,12-,13+/m0/s1 |
| InChIKey |
NWPSNKOKHQSQHW-AQUOVQTQSA-N |
| Molecular Weight |
271.288 g/mol |
| SMILES |
C(C)(C)(OC(N1C[C@]2([C@@]3(COC([C@]3(F)C2)=O)C1)[H])=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.980255 |
![N-Tert-butoxycarbonyl-7-fluor-3-aza-9-oxatricyclo[5.3.0.01,5]decan-8-one](/api/spectrum/VuLd20u1PB/structure.png?h=300&w=458 "N-Tert-butoxycarbonyl-7-fluor-3-aza-9-oxatricyclo[5.3.0.01,5]decan-8-one")
