| SpectraBase Spectrum ID |
3rDIDLMFJg |
| Name |
trans-Ethyl 6-Isobutyl-2-methyl-4-oxocyclohex-2-ene-1-carboxylate |
| Appearance |
Colorless liquid |
| Carrier Gas |
Hydrogen |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.156894565 u |
| Formula |
C14H22O3 |
| GC Column |
ZB-1 (20 m x0.18 mm, film thickness 0.18 micrometer) |
| InChI |
InChI=1S/C14H22O3/c1-5-17-14(16)13-10(4)7-12(15)8-11(13)6-9(2)3/h7,9,11,13H,5-6,8H2,1-4H3/t11-,13-/m0/s1 |
| InChIKey |
ISHAANVVWNKWPI-AAEUAGOBSA-N |
| Instrument Name |
Shimadzu QP 2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/hlca.202300040 |
| Molecular Weight |
238.327 g/mol |
| Quality |
222 |
| SMILES |
C(C)OC(=O)[C@]1(C(=CC(C[C@@]1(CC(C)C)[H])=O)C)[H] |
| SPLASH |
splash10-0pdi-2900000000-1424979478d4b992e2f5 |
| Sample Comments |
dr = 1:1.4 |
| Source of Spectrum |
H-106-8-23 trans (DOI: 10.1002/hlca.202300040) |
| Wiley ID |
1911469 |
