| SpectraBase Spectrum ID |
DxlzhXkIqeu |
| Name |
(3S,3aS,7aR)-3-butyl-3a,4,5,6,7,7a-hexahydro-3H-isobenzofuran-1-one |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
196.146329882 u |
| Formula |
C12H20O2 |
| GC Column |
Fused silica (25 m x 0.20 mm, film thickness 0.33 micrometer) |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C12H20O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h9-11H,2-8H2,1H3/t9-,10+,11-/m0/s1 |
| InChIKey |
TZRMFZSOOVBPPN-AXFHLTTASA-N |
| Inlet Type |
Split |
| Instrument Name |
Fisons GC 8000-Fisons MD 800 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhrc.1240200502 |
| Molecular Weight |
196.290 g/mol |
| Quality |
563 |
| SMILES |
C1C[C@@]2([C@](CC1)([C@@](OC2=O)(CCCC)[H])[H])[H] |
| SPLASH |
splash10-00lr-9000000000-9a8bf2134ee93ad78810 |
| Source of Spectrum |
HRC-20-252-1 (DOI: 10.1002/jhrc.1240200502) |
| Wiley ID |
1910895 |
