SpectraBase Spectrum ID |
JGwruSDxaMa |
Name |
(3aR,4R,7R)-1,4,9,9-Tetramethyl-3,4,5,6,7,8-hexahydro-2H-3a,7-methanoazulen-2-one |
CAS Registry Number |
3466-15-7 |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
218.167065327 u |
Formula |
C15H22O |
InChI |
InChI=1S/C15H22O/c1-9-11-7-10-5-6-15(4,14(10,2)3)12(11)8-13(9)16/h10,12H,5-8H2,1-4H3/t10-,12-,15-/m1/s1 |
InChIKey |
UUXICWBSFZDYLB-IXPVHAAZSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
218.340 g/mol |
Nominal Mass |
218 u |
Quality |
929 |
Retention Index |
1657 |
SMILES |
[C@]12(C([C@@](CC=3[C@]2(CC(C3C)=O)[H])(CC1)[H])(C)C)C |
SPLASH |
splash10-014i-6920000000-528b7028ba507f6422ea |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Technique |
GC/MS |
Wiley ID |
DD2024_026398 |