| SpectraBase Spectrum ID |
ne7YKHsfs1 |
| Name |
Methyl 2-(N-tert-butoxycarbonyl-p-toluenesulfonamidoethyl)-3,3-difluoroacrylate |
| Comments |
Note: The molecular formula of the structure shown is C18H23F2NO6S - which differs from the formula reported for the mass spectrum (C18H25F2NO6S) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H25F2NO6S |
| InChI |
InChI=1S/C18H23F2NO6S/c1-12-6-8-13(9-7-12)28(24,25)21(17(23)27-18(2,3)4)11-10-14(15(19)20)16(22)26-5/h6-9H,10-11H2,1-5H3 |
| InChIKey |
CWSIWNVZOLNASF-UHFFFAOYSA-N |
| Molecular Weight |
419.440 g/mol |
| SMILES |
C(C)(C)(C)OC(=O)N(S(=O)(=O)c1ccc(cc1)C)CCC(C(=O)OC)=C(F)F |
| SPLASH |
splash10-0a4i-4902000000-100cc6ea8cffd2c23cca |
| Source of Spectrum |
C5-2002-1931-20 |
| Wiley ID |
1614989 |
