| SpectraBase Spectrum ID |
40K4vxT1vf5 |
| Name |
2-Methyl-3,6-dioxo-5-tolyl-2,5-diazabicyclo[2.2.2[octan-1-yl Thiocyanate |
| Alternate Name(s) |
2-Methyl-5-(2-methylphenyl)-3,6-dioxo-2,5-diazabicyclo[2.2.2]oct-1-yl thiocyanate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H15N3O2S |
| InChI |
InChI=1S/C15H15N3O2S/c1-10-5-3-4-6-11(10)18-12-7-8-15(14(18)20,21-9-16)17(2)13(12)19/h3-6,12H,7-8H2,1-2H3/t12-,15+/m1/s1 |
| InChIKey |
QMTBMIOINOFWRH-DOMZBBRYSA-N |
| Molecular Weight |
301.364 g/mol |
| SMILES |
[C@@]12(C(N(c3c(C)cccc3)[C@](CC1)(C(N2C)=O)[H])=O)SC#N |
| SPLASH |
splash10-0f6x-2907000000-d429c82a03105c42534d |
| Source of Spectrum |
F-47-9267-7 |
| Wiley ID |
1303730 |
