| SpectraBase Spectrum ID |
9JXwp1hkmmI |
| Name |
Methyl 4-(2-(2-methylallyl)cyclobut-1-en-1-yl)benzoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.130679818 u |
| Formula |
C16H18O2 |
| InChI |
InChI=1S/C16H18O2/c1-11(2)10-14-8-9-15(14)12-4-6-13(7-5-12)16(17)18-3/h4-7H,1,8-10H2,2-3H3 |
| InChIKey |
OUUBVKVZOOKWBO-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201604585 |
| Molecular Weight |
242.318 g/mol |
| Quality |
151 |
| Reported Formula |
C16H18O2 |
| SMILES |
COC(C1=CC=C(C=C1)C1=C(CC1)CC(=C)C)=O |
| SPLASH |
splash10-00o0-0900000000-9881f8ad6ee3a2add6af |
| Source of Spectrum |
QE-23-SM28-19c (DOI: 10.1002/chem.201604585) |
| Thin-Layer Chromatography |
0.6 (hexane/EtOAc, 9:1, UV, KMnO4, PAA) |
| Wiley ID |
1903874 |
