SpectraBase Spectrum ID |
AX3AuCuf1Bd |
Name |
cis-1,3,3A,9B-Tetrahydronaphtho[1,2-C]furan-5(4H)-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
188.083729624 u |
Formula |
C12H12O2 |
InChI |
InChI=1S/C12H12O2/c13-12-5-8-6-14-7-11(8)9-3-1-2-4-10(9)12/h1-4,8,11H,5-7H2/t8-,11+/m1/s1 |
InChIKey |
AJDWDZSHNOJBMU-KCJUWKMLSA-N |
Molecular Weight |
188.226 g/mol |
SMILES |
C12=C(C(=O)C[C@]3([C@@]2(COC3)[H])[H])C=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.865514 |