| SpectraBase Spectrum ID |
9iMXipTUcp4 |
| Name |
(2S,8S)-2-(Tert-butoxycarbonylamino)-3-keto-pyrrolizidine-8-carboxylic acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
298.152871811 u |
| Formula |
C14H22N2O5 |
| InChI |
InChI=1S/C14H22N2O5/c1-13(2,3)21-12(19)15-9-8-14(11(18)20-4)6-5-7-16(14)10(9)17/h9H,5-8H2,1-4H3,(H,15,19)/t9-,14-/m0/s1 |
| InChIKey |
FBADRCVZEZPZTE-XPTSAGLGSA-N |
| SMILES |
[C@@]12(N(C([C@](C2)(NC(OC(C)(C)C)=O)[H])=O)CCC1)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.880289 |
