| SpectraBase Spectrum ID |
8P1XOaWxd5O |
| Name |
Cyclobutanone |
| CAS Registry Number |
1191-95-3 |
| 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 |
70.041864812 u |
| Formula |
C4H6O |
| 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/C4H6O/c5-4-2-1-3-4/h1-3H2 |
| InChIKey |
SHQSVMDWKBRBGB-UHFFFAOYSA-N |
| Molecular Weight |
70.091 g/mol |
| Nominal Mass |
70 u |
| Number of Peaks |
19 |
| SMILES |
C1CCC1=O |
| SPLASH |
splash10-0006-9000000000-58ee7ac97e374d0c662a |
| Source |
ex ALDRICH ex JJ BROPHY |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001505 |
