SpectraBase Spectrum ID |
2hiZCXfUORm |
Name |
Naphthalene, 1,2,3,4-tetrahydro-6-methyl-5-nitro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
191.094628661 u |
Formula |
C11H13NO2 |
InChI |
InChI=1S/C11H13NO2/c1-8-6-7-9-4-2-3-5-10(9)11(8)12(13)14/h6-7H,2-5H2,1H3 |
InChIKey |
ZUYYNZMAVUREES-UHFFFAOYSA-N |
Molecular Weight |
191.230 g/mol |
SMILES |
C1(N(=O)=O)=C2C(CCCC2)=CC=C1C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903272 |