| SpectraBase Spectrum ID |
FZFlAk4HElx |
| Name |
3,3'-Dichloro-10,11-dihydrospiro[5H-dibenzo[A,D]cycloheptene-5,2'-thiirane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.003676960 u |
| Formula |
C16H12Cl2S |
| InChI |
InChI=1S/C16H12Cl2S/c17-16(18)15(19-16)13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)15/h1-8H,9-10H2 |
| InChIKey |
VFPDDALTZYBDSN-UHFFFAOYSA-N |
| Molecular Weight |
307.238 g/mol |
| SMILES |
C12(C(Cl)(Cl)S2)C2=C(CCC3=C1C=CC=C3)C=CC=C2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.984222 |
![3,3'-Dichloro-10,11-dihydrospiro[5H-dibenzo[a,d]cycloheptene-5,2'-thiirane](/api/spectrum/FZFlAk4HElx/structure.png?h=300&w=458 "3,3'-Dichloro-10,11-dihydrospiro[5H-dibenzo[a,d]cycloheptene-5,2'-thiirane")
