SpectraBase Spectrum ID |
9wx9gKzRaUe |
Name |
Bicyclo[2.2.1]heptan-2-one, 6-chloro-5-[(2-nitrophenyl)thio]-, (5-exo,6-endo)-(.+-.)- |
CAS Registry Number |
126577-72-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H12ClNO3S |
InChI |
InChI=1S/C13H12ClNO3S/c14-12-8-5-7(6-10(8)16)13(12)19-11-4-2-1-3-9(11)15(17)18/h1-4,7-8,12-13H,5-6H2/t7-,8+,12?,13?/m1/s1 |
InChIKey |
BTJBEGBDMWKLAE-JFGCWXGISA-N |
Molecular Weight |
297.756 g/mol |
SMILES |
c1(N(=O)=O)c(SC2[C@@]3(C[C@](C2Cl)(C(=O)C3)[H])[H])cccc1 |
SPLASH |
splash10-004i-9200000000-86f16ac5213d4da4e9bf |
Source of Spectrum |
H-72-1022-23 |
Synonyms |
6-Chloro-5-[(2-nitrophenyl)sulfanyl]bicyclo[2.2.1]heptan-2-one
6-endo-chloro-5-exo-(2-nitrobenzenesulfenyl)bicyclo[2.2.1]heptan-2-one |
Wiley ID |
1299950 |