| SpectraBase Spectrum ID |
HBHaqtANc3l |
| Name |
1,4-Methanoazulen-7(1H)-one, octahydro-1,5,5,8A-tetramethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.182715392 u |
| Formula |
C15H24O |
| InChI |
InChI=1S/C15H24O/c1-13(2)7-10(16)8-15(4)11-5-6-14(15,3)9-12(11)13/h11-12H,5-9H2,1-4H3/t11-,12+,14+,15?/m1/s1 |
| InChIKey |
BMLTXHGGEJNZIS-JNZNFYPTSA-N |
| Molecular Weight |
220.356 g/mol |
| SMILES |
C1(CC(CC2([C@]3([C@@]1(C[C@]2(C)CC3)[H])[H])C)=O)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971828 |
