| SpectraBase Spectrum ID |
CCuHYJQR9MW |
| Name |
Pipitzol |
| CAS Registry Number |
106790-99-2 |
| 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 |
262.156894565 u |
| Formula |
C16H22O3 |
| 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/C16H22O3/c1-8-6-7-10-15(3,4)11-9(2)12(19-5)14(18)16(8,10)13(11)17/h8,10-11H,6-7H2,1-5H3/t8-,10?,11+,16+/m0/s1 |
| InChIKey |
NFANDAUYLLKKGW-GQBUWSKWSA-N |
| Molecular Weight |
262.349 g/mol |
| Nominal Mass |
262 u |
| Number of Peaks |
203 |
| SMILES |
COC1=C([C@]2(C(C3[C@@]([C@](CC3)(C)[H])(C1=O)C2=O)(C)C)[H])C |
| SPLASH |
splash10-06si-3890000000-f0fe98c51d3cc97b5ff2 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001145 |
