SpectraBase Spectrum ID |
8NAnNAFSDi1 |
Name |
(3as,6ar)-5-((S)-1-Phenyl-ethyl)-hexahydro-furo[3,4-C]pyrrol-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
231.125928789 u |
Formula |
C14H17NO2 |
InChI |
InChI=1S/C14H17NO2/c1-10(11-5-3-2-4-6-11)15-7-12-9-17-14(16)13(12)8-15/h2-6,10,12-13H,7-9H2,1H3/t10-,12-,13-/m0/s1 |
InChIKey |
IROBHAKOTFIDIP-DRZSPHRISA-N |
Molecular Weight |
231.295 g/mol |
SMILES |
C1N(C[C@]2(COC([C@@]12[H])=O)[H])[C@](C1=CC=CC=C1)(C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.861829 |