SpectraBase Spectrum ID |
8Wz9JrBxJsC |
Name |
1,4,6-Trimethyl-1,2,3,3A,4,7,8,8A-octahydro-4,7-ethanoazulene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
204.187800773 u |
Formula |
C15H24 |
InChI |
InChI=1S/C15H24/c1-10-4-5-14-13(10)8-12-6-7-15(14,3)9-11(12)2/h9-10,12-14H,4-8H2,1-3H3 |
InChIKey |
XAAMMPKFMNZIIC-UHFFFAOYSA-N |
Molecular Weight |
204.357 g/mol |
SMILES |
C1(CCC2C1CC1C(=CC2(CC1)C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942839 |