| SpectraBase Spectrum ID |
Hj8bsZAt62D |
| Name |
3A-cis-3A,4-Trans-1,2,3,3A,4,6A-hexahydro-2-methyl-1,3-dioxo-4,6-diphenylpyrrolo[3,4-C]pyrrole |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.121177761 u |
| Formula |
C19H16N2O2 |
| InChI |
InChI=1S/C19H16N2O2/c1-21-18(22)14-15(19(21)23)17(13-10-6-3-7-11-13)20-16(14)12-8-4-2-5-9-12/h2-11,14-16H,1H3/t14-,15?,16-/m1/s1 |
| InChIKey |
OKNJPZWFTHYSRD-YTPLPTRZSA-N |
| Molecular Weight |
304.349 g/mol |
| SMILES |
C12[C@@](C(=O)N(C2=O)C)([C@@](C2=CC=CC=C2)(N=C1C=1C=CC=CC1)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923364 |
![3a-cis-3a,4-trans-1,2,3,3a,4,6a-Hexahydro-2-methyl-1,3-dioxo-4,6-diphenylpyrrolo[3,4-c]pyrrole](/api/spectrum/Hj8bsZAt62D/structure.png?h=300&w=458 "3a-cis-3a,4-trans-1,2,3,3a,4,6a-Hexahydro-2-methyl-1,3-dioxo-4,6-diphenylpyrrolo[3,4-c]pyrrole")
