| SpectraBase Spectrum ID |
8ykQkcRU4vq |
| Name |
9-Phenyl-2,3-cis-di(methoxycarbonyl)-1,2,3,4,4A-pentahydro-9-dehydrofluorene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
362.151809184 u |
| Formula |
C23H22O4 |
| InChI |
InChI=1S/C23H22O4/c1-26-22(24)19-12-17-15-10-6-7-11-16(15)21(14-8-4-3-5-9-14)18(17)13-20(19)23(25)27-2/h3-11,17,19-20H,12-13H2,1-2H3/t17?,19-,20+/m1/s1 |
| InChIKey |
XRTFRJFNOULCSF-GQXIWKRZSA-N |
| Molecular Weight |
362.425 g/mol |
| SMILES |
C12=C(C3=CC=CC=C3C2C[C@]([C@](C1)(C(=O)OC)[H])(C(=O)OC)[H])C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903836 |
