| SpectraBase Spectrum ID |
FrerZXpVz8t |
| Name |
7-Chloro-2,5-epoxy-1-phenyl-bicyclo[4.4.0]->delta.3,4-.delta.6,7-decadiene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
258.081142802 u |
| Formula |
C16H15ClO |
| InChI |
InChI=1S/C16H15ClO/c17-11-8-13-12-6-7-14(18-15(12)9-11)16(13)10-4-2-1-3-5-10/h1-7,9,12-16H,8H2/t12-,13-,14+,15+,16?/m1/s1 |
| InChIKey |
BVEXWKPJGWYHKM-WHWZVRATSA-N |
| Molecular Weight |
258.748 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@](O[C@](C2C2=CC=CC=C2)(C=C3)[H])(C=C(C1)Cl)[H])[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913103 |
![7-Chloro-2,5-epoxy-1-phenyl-bicyclo[4.4.0]->delta.3,4-.delta.6,7-decadiene](/api/spectrum/FrerZXpVz8t/structure.png?h=300&w=458 "7-Chloro-2,5-epoxy-1-phenyl-bicyclo[4.4.0]->delta.3,4-.delta.6,7-decadiene")
