| SpectraBase Spectrum ID |
2uyvm3I3Bfj |
| Name |
1,2,3,4,4A.alpha.,5.alpha.,5A.beta.,11B.beta.-Octahydro-5-methoxycarbonyl-6H-chromeno[3,4-B]indolizine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
287.152143537 u |
| Formula |
C17H21NO3 |
| InChI |
InChI=1S/C17H21NO3/c1-20-17(19)15-12-10-21-14-8-3-2-6-11(14)16(12)18-9-5-4-7-13(15)18/h2-3,6,8,12-13,15-16H,4-5,7,9-10H2,1H3/t12-,13-,15?,16-/m0/s1 |
| InChIKey |
VBDOPCNROSHVQJ-KVROMUSXSA-N |
| SMILES |
[C@@]12(N3[C@](C([C@@]2(COC2=C1C=CC=C2)[H])C(=O)OC)(CCCC3)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.816086 |
![1,2,3,4,4a.alpha.,5.alpha.,5a.beta.,11b.beta.-octahydro-5-methoxycarbonyl-6H-chromeno[3,4-b]indolizine](/api/spectrum/2uyvm3I3Bfj/structure.png?h=300&w=458 "1,2,3,4,4a.alpha.,5.alpha.,5a.beta.,11b.beta.-octahydro-5-methoxycarbonyl-6H-chromeno[3,4-b]indolizine")
