SpectraBase Spectrum ID |
C9iDmsOGHjo |
Name |
Butyl 2-(7-fluoro-4-(4-fluorophenyl)-2-tosyl-1,2-dihydrophthalazin-1-yl)acetate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H26F2N2O4S |
InChI |
InChI=1S/C27H26F2N2O4S/c1-3-4-15-35-26(32)17-25-24-16-21(29)11-14-23(24)27(19-7-9-20(28)10-8-19)30-31(25)36(33,34)22-12-5-18(2)6-13-22/h5-14,16,25H,3-4,15,17H2,1-2H3 |
InChIKey |
CBJGQTRXFQNAHA-UHFFFAOYSA-N |
Literature Reference DOI |
10.1021/ol302522n |
Molecular Weight |
512.572 g/mol |
SMILES |
c1c(ccc(c1)C=1c2c(cc(cc2)F)C(CC(OCCCC)=O)N(S(c2ccc(cc2)C)(=O)=O)N1)F |
SPLASH |
splash10-0002-2009000000-3371f20a98f5adbef48b |
Source of Spectrum |
A1-14-5338/SMS10-3da |
Wiley ID |
1750658 |