| SpectraBase Spectrum ID |
JbjgLMKIoKS |
| Name |
Squamulosone |
| CAS Registry Number |
34413-94-0 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
218.167065327 u |
| Formula |
C15H22O |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C15H22O/c1-8-5-6-10-9(2)12(16)7-11-14(13(8)10)15(11,3)4/h8,11,13-14H,5-7H2,1-4H3/t8-,11-,13-,14-/m1/s1 |
| InChIKey |
FUIPJCVSKAWFTI-KLPZLMTLSA-N |
| Molecular Weight |
218.340 g/mol |
| Nominal Mass |
218 u |
| Number of Peaks |
115 |
| SMILES |
[C@]12([H])C(=C(C)C(=O)C[C@]3(C(C)(C)[C@@]23[H])[H])CC[C@]1(C)[H] |
| SPLASH |
splash10-006x-7910000000-6e8f13aa89effc9cbe25 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001283 |
