| SpectraBase Spectrum ID |
GDrYq9zrbYz |
| Name |
5-exo-Chloro-4,5,6,7-tetrahydro-4,7-methano-8-anti-(4-nitrophenylthio)-1,3-diphenylisobenzofuran |
| Alternate Name(s) |
5-exo-Chloro-4,5,6,7-tetrahydro-4,7-methano-1,3-diphenyl-8-anti-(4-nitrophenylthio)-1,3-diphenylisobenzofuran
8-chloro-10-[(4-nitrophenyl)sulfanyl]-3,5-diphenyl-4-oxatricyclo[5.2.1.0(2,6)]deca-2,5-diene
8-chloro-3,5-diphenyl-4-oxatricyclo[5.2.1.0(2,6)]deca-2,5-dien-10-yl 4-nitrophenyl sulfide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H20ClNO3S |
| InChI |
InChI=1S/C27H20ClNO3S/c28-21-15-20-22-24(23(21)27(20)33-19-13-11-18(12-14-19)29(30)31)26(17-9-5-2-6-10-17)32-25(22)16-7-3-1-4-8-16/h1-14,20-21,23,27H,15H2/t20-,21+,23+,27?/m0/s1 |
| InChIKey |
AHPBXLFEIPYDPU-CDYNNBROSA-N |
| Molecular Weight |
473.974 g/mol |
| SMILES |
c12c(c(-c3ccccc3)oc1-c1ccccc1)[C@]1(C([C@@]2([C@@](C1)(Cl)[H])[H])Sc1ccc(N(=O)=O)cc1)[H] |
| SPLASH |
splash10-001i-0090600000-f9691123d58f39169592 |
| Source of Spectrum |
AJ-72-1602-32 |
| Wiley ID |
775043 |
