SpectraBase Spectrum ID |
8GKRizXvdjm |
Name |
Tricyclo[3.2.1.02,7]oct-3-ene-1-carboxylic acid, 3-chloro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
184.029107228 u |
Formula |
C9H9ClO2 |
InChI |
InChI=1S/C9H9ClO2/c10-6-2-4-1-5-7(6)9(5,3-4)8(11)12/h2,4-5,7H,1,3H2,(H,11,12) |
InChIKey |
DARXRIQIKSTGMS-UHFFFAOYSA-N |
Molecular Weight |
184.622 g/mol |
SMILES |
C12(C3C(Cl)=CC(C2)CC13)C(=O)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966496 |