SpectraBase Compound ID | 5gjwLniC6a7 |
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InChI | InChI=1S/C27H24F21NO2/c1-5-12-49(16(50)51-17(2,3)4)13-15-8-6-14(7-9-15)10-11-18(28,29)19(30,31)20(32,33)21(34,35)22(36,37)23(38,39)24(40,41)25(42,43)26(44,45)27(46,47)48/h6-11H,5,12-13H2,1-4H3/b11-10+ |
InChIKey | YYQJYWCAFOYJGR-ZHACJKMWSA-N |
Mol Weight | 793.46 g/mol |
Molecular Formula | C27H24F21NO2 |
Exact Mass | 793.14717 g/mol |
SpectraBase Spectrum ID | 2K5RErammbp |
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Name | 1-[N-(tert-Butoxycarbonyl)-N-propylaminomethyl]-4-[2-(uneicosafluorodecyl)ethenyl)benzene |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C27H24F21NO2 |
InChI | InChI=1S/C27H24F21NO2/c1-5-12-49(16(50)51-17(2,3)4)13-15-8-6-14(7-9-15)10-11-18(28,29)19(30,31)20(32,33)21(34,35)22(36,37)23(38,39)24(40,41)25(42,43)26(44,45)27(46,47)48/h6-11H,5,12-13H2,1-4H3/b11-10+ |
InChIKey | YYQJYWCAFOYJGR-ZHACJKMWSA-N |
Molecular Weight | 793.460 g/mol |
SMILES | C(C(C(C(C(C(\C=C\c1ccc(CN(C(OC(C)(C)C)=O)CCC)cc1)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F |
SPLASH | splash10-000i-0000009000-8f250a99909762dda9c2 |
Source of Spectrum | F-70-3413-5 |
Synonyms | N-[[4-[(E)-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heneicosafluorododec-1-enyl]phenyl]methyl]-N-propylcarbamic acid tert-butyl ester tert-butyl N-[[4-[(E)-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododec-1-enyl]phenyl]methyl]-N-propylcarbamate tert-butyl N-[[4-[(E)-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododec-1-enyl]phenyl]methyl]-N-propyl-carbamate tert-butyl N-[[4-[(E)-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosakis(fluoranyl)dodec-1-enyl]phenyl]methyl]-N-propyl-carbamate |
Wiley ID | 1596804 |