SpectraBase Spectrum ID |
GNb4VQyLqcl |
Name |
Cyclopenta[C]pentalene-4-methanol, decahydro-1,3A,5A-trimethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
222.198365456 u |
Formula |
C15H26O |
InChI |
InChI=1S/C15H26O/c1-11-5-8-14(3)12(10-16)9-13(2)6-4-7-15(11,13)14/h11-12,16H,4-10H2,1-3H3 |
InChIKey |
YGYPMHNDZLWPLR-UHFFFAOYSA-N |
Molecular Weight |
222.372 g/mol |
SMILES |
C123C(C(CO)CC3(CCC1)C)(CCC2C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.876056 |