For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Chloro-2-[2-nitro-5-(pentafluoro-$l^{6}-sulfanyl)phenyl]acetic acid methyl ester
SpectraBase Compound ID HqXLRnHX3Nf
InChI InChI=1S/C9H7ClF5NO4S/c1-20-9(17)8(10)6-4-5(21(11,12,13,14)15)2-3-7(6)16(18)19/h2-4,8H,1H3
InChIKey OJJKAWSEGFSOAA-UHFFFAOYSA-N
Mol Weight 355.66 g/mol
Molecular Formula C9H7ClF5NO4S
Exact Mass 354.970447 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8fwbKSQfa5G
Name 2-Chloro-2-[2-nitro-5-(pentafluoro-$l^{6}-sulfanyl)phenyl]acetic acid methyl ester
Alternate Name(s) Methyl 2-chloro-2-[2-nitro-5-(pentafluoro-$l^{6}-sulfanyl)phenyl]acetate Methyl 2-chloranyl-2-[2-nitro-5-[pentakis(fluoranyl)-$l^{6}-sulfanyl]phenyl]ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7ClF5NO4S
InChI InChI=1S/C9H7ClF5NO4S/c1-20-9(17)8(10)6-4-5(21(11,12,13,14)15)2-3-7(6)16(18)19/h2-4,8H,1H3
InChIKey OJJKAWSEGFSOAA-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo200618p
Molecular Weight 355.663 g/mol
SMILES c1(S(F)(F)(F)(F)F)ccc(c(c1)C(C(=O)OC)Cl)[N+](=O)[O-]
SPLASH splash10-0a4i-9270000000-605b639f750e52fdf8db
Source of Spectrum J-76-4784-4d
Wiley ID 1744818