SpectraBase Spectrum ID |
8ewVM9lAR4t |
Name |
7-Fluoro-1,2-dihydro-naphthalene-1,2-diol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
180.058657691 u |
Formula |
C10H9FO2 |
InChI |
InChI=1S/C10H9FO2/c11-7-3-1-6-2-4-9(12)10(13)8(6)5-7/h1-5,9-10,12-13H/t9-,10+/m0/s1 |
InChIKey |
PZMQSUOWWYEAEN-VHSXEESVSA-N |
Molecular Weight |
180.178 g/mol |
SMILES |
C1(=CC=C2C=C[C@@]([C@@](C2=C1)(O)[H])(O)[H])F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.867415 |