SpectraBase Spectrum ID |
KwjFDBBgVZS |
Name |
1-(3,3-Dimethylbicyclo[2.2.1]hept-2-yl)-1-propanol, o-acetyl |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
224.177630011 u |
Formula |
C14H24O2 |
InChI |
InChI=1S/C14H24O2/c1-5-12(16-9(2)15)13-10-6-7-11(8-10)14(13,3)4/h10-13H,5-8H2,1-4H3 |
InChIKey |
OFLPHWWUHKQZLH-UHFFFAOYSA-N |
Molecular Weight |
224.344 g/mol |
SMILES |
C(OC(=O)C)(CC)C1C(C)(C)C2CC1CC2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.889735 |