| SpectraBase Spectrum ID |
KW2Mx7heuSp |
| Name |
1H-Cyclopropa[L]phenanthrene, 1A,9B-dihydro-1A,9B-bis(methylsulfonyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.049001339 u |
| Formula |
C17H16O4S2 |
| InChI |
InChI=1S/C17H16O4S2/c1-22(18,19)16-11-17(16,23(2,20)21)15-10-6-4-8-13(15)12-7-3-5-9-14(12)16/h3-10H,11H2,1-2H3 |
| InChIKey |
VJTAQPFRLBUNGC-UHFFFAOYSA-N |
| Molecular Weight |
348.431 g/mol |
| SMILES |
C12(C(S(=O)(=O)C)(C3=CC=CC=C3C3=C2C=CC=C3)C1)S(=O)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879864 |
![1H-Cyclopropa[l]phenanthrene, 1a,9b-dihydro-1a,9b-bis(methylsulfonyl)-](/api/spectrum/KW2Mx7heuSp/structure.png?h=300&w=458 "1H-Cyclopropa[l]phenanthrene, 1a,9b-dihydro-1a,9b-bis(methylsulfonyl)-")
