SpectraBase Spectrum ID |
GjOh9Ii4bIQ |
Name |
(1-Adamantyl)-tert-butylketene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
232.182715392 u |
Formula |
C16H24O |
InChI |
InChI=1S/C16H24O/c1-15(2,3)14(10-17)16-7-11-4-12(8-16)6-13(5-11)9-16/h11-13H,4-9H2,1-3H3/t11-,12+,13-,16- |
InChIKey |
KCFXOCBNJGXAQR-WTHWONHRSA-N |
Molecular Weight |
232.367 g/mol |
SMILES |
C12(C(=C=O)C(C)(C)C)C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92073 |