SpectraBase Spectrum ID |
H8ApdOZD8aS |
Name |
Phenyl(10-(3-(trifluoromethyl)phenyl)phenanthren-9-yl)sulfane |
Appearance |
Yellow solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
430.100306210 u |
Formula |
C27H17F3S |
InChI |
InChI=1S/C27H17F3S/c28-27(29,30)19-10-8-9-18(17-19)25-23-15-6-4-13-21(23)22-14-5-7-16-24(22)26(25)31-20-11-2-1-3-12-20/h1-17H |
InChIKey |
CWNOWWYWEFRTFD-UHFFFAOYSA-N |
Instrument Name |
LRMS |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/jo302634n |
Molecular Weight |
430.488 g/mol |
Reported Formula |
C27H17F3S |
SMILES |
C1=CC2=C(C=C1)C(=C(C1=C2C=CC=C1)C1=CC(=CC=C1)C(F)(F)F)SC1=CC=CC=C1 |
SPLASH |
splash10-0kmi-0096100000-9b1f89796f478771e96f |
Source of Spectrum |
JOC-78-1303-15 (DOI: 10.1021/jo302634n) |
Wiley ID |
1912198 |