SpectraBase Spectrum ID |
C5YniZPuJKL |
Name |
2-Isobutylbicyclo[2.2.1]heptane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
152.156500644 u |
Formula |
C11H20 |
InChI |
InChI=1S/C11H20/c1-8(2)5-11-7-9-3-4-10(11)6-9/h8-11H,3-7H2,1-2H3/t9-,10+,11+/m1/s1 |
InChIKey |
FUYHDFCORAHYRE-VWYCJHECSA-N |
Molecular Weight |
152.281 g/mol |
SMILES |
C1C[C@@]2([C@](C[C@]1(C2)[H])(CC(C)C)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934647 |