SpectraBase Spectrum ID |
BB8i0KvmfjL |
Name |
7-(Methylthio)-5,6-dihydronaphtha[b]carbalzole |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H17NS |
InChI |
InChI=1S/C21H17NS/c1-23-21-15-11-10-13-6-2-3-7-14(13)17(15)12-19-20(21)16-8-4-5-9-18(16)22-19/h2-9,12,22H,10-11H2,1H3 |
InChIKey |
CLBKCAXXZVWCGC-UHFFFAOYSA-N |
Molecular Weight |
315.434 g/mol |
SMILES |
[nH]1c2c(c3c1cc1-c4c(CCc1c3SC)cccc4)cccc2 |
SPLASH |
splash10-014i-0095000000-5e96ac2e3737d2e5a8f7 |
Source of Spectrum |
AT-39-2032-6 |
Wiley ID |
854113 |