SpectraBase Spectrum ID |
2QgmkPM3tc7 |
Name |
1(2H)-Naphthalenone, 6-(1,1-dimethylethyl)-3,4-dihydro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
202.135765199 u |
Formula |
C14H18O |
InChI |
InChI=1S/C14H18O/c1-14(2,3)11-7-8-12-10(9-11)5-4-6-13(12)15/h7-9H,4-6H2,1-3H3 |
InChIKey |
DLKWBLCTQGSTEL-UHFFFAOYSA-N |
Molecular Weight |
202.297 g/mol |
SMILES |
C1(=O)C2=C(C=C(C=C2)C(C)(C)C)CCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969786 |