SpectraBase Spectrum ID |
Cj4gf6ejusV |
Name |
2,3-bis(Chloromethyl)bicyclo[2.2.1]hept-5-ene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
190.031605786 u |
Formula |
C9H12Cl2 |
InChI |
InChI=1S/C9H12Cl2/c10-4-8-6-1-2-7(3-6)9(8)5-11/h1-2,6-9H,3-5H2/t6-,7-,8?,9?/m1/s1 |
InChIKey |
XPIGEELBPDQNLE-PZYMCFGQSA-N |
Molecular Weight |
191.101 g/mol |
SMILES |
[C@]12(C(C(CCl)[C@@](C2)(C=C1)[H])CCl)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927316 |