| SpectraBase Spectrum ID |
B9QGkyYguNL |
| Name |
methyl 4-((3-((5-(4-fluorophenyl)thiophen-2-yl)methyl)-4-methylphenyl)(4-methoxyphenyl)methyl)benzoate |
| Appearance |
Waxy oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
536.182144128 u |
| Formula |
C34H29FO3S |
| InChI |
InChI=1S/C34H29FO3S/c1-22-4-5-27(20-28(22)21-31-18-19-32(39-31)23-10-14-29(35)15-11-23)33(25-12-16-30(37-2)17-13-25)24-6-8-26(9-7-24)34(36)38-3/h4-20,33H,21H2,1-3H3 |
| InChIKey |
MTDJSSIDSOKAHN-UHFFFAOYSA-N |
| Instrument Name |
FINNIGAN MAT 95Q |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202101682 |
| Molecular Weight |
536.661 g/mol |
| Reported Formula |
C34H29FO3S |
| SMILES |
C1(C(C2=CC=C(C(=C2)CC=2SC(=CC2)C2=CC=C(C=C2)F)C)C2=CC=C(C=C2)OC)=CC=C(C=C1)C(=O)OC |
| SPLASH |
splash10-000i-0102090000-2aac9d9ea853e8a3c44f |
| Source of Spectrum |
ACI-60-SM25-5l (DOI: 10.1002/anie.202101682) |
| Wiley ID |
1891260 |
