SpectraBase Spectrum ID |
IiBsPr3P90G |
Name |
Anti-2'-oxa-3'-oxospiro[bicyclo[2.2.1]hept-2-ene-anti-7,1'-cyclopentane] |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
164.083729624 u |
Formula |
C10H12O2 |
InChI |
InChI=1S/C10H12O2/c11-9-5-6-10(12-9)7-1-2-8(10)4-3-7/h1-2,7-8H,3-6H2/t7-,8+,10- |
InChIKey |
YPGQYZGURSRUGK-DIYOJNKTSA-N |
Molecular Weight |
164.204 g/mol |
SMILES |
[C@]12(OC(=O)CC2)[C@@]2(C=C[C@]1(CC2)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948678 |