| SpectraBase Spectrum ID |
EF0QZXQ1hFl |
| Name |
1-Phenanthrenepropanenitrile, 1,2,3,4,4a,9,10,10a-octahydro-5-methyl-2-methylene-, [1S-(1.alpha.,4a.beta.,10a.alpha.)]- |
| CAS Registry Number |
54212-43-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H23N |
| InChI |
InChI=1S/C19H23N/c1-13-8-10-18-17(16(13)7-4-12-20)11-9-15-6-3-5-14(2)19(15)18/h3,5-6,16-18H,1,4,7-11H2,2H3/t16-,17+,18+/m1/s1 |
| InChIKey |
BJYGAFMOVGMTKV-SQNIBIBYSA-N |
| Molecular Weight |
265.400 g/mol |
| SMILES |
[C@@]12([C@]([C@](CCC#N)(C(CC2)=C)[H])(CCc2c1c(ccc2)C)[H])[H] |
| SPLASH |
splash10-052f-0920000000-fe28556a5da1604763e0 |
| Source of Spectrum |
KO-5-85-1 |
| Synonyms |
1-Methyl-13,17-seco-oestra-1,3,5(10),13(18)-tetraene-17-nitrile
3-[(1S,4aS,10aS)-5-methyl-2-methylene-1,2,3,4,4a,9,10,10a-octahydro-1-phenanthrenyl]propanenitrile |
| Wiley ID |
1269279 |
![1-Phenanthrenepropanenitrile, 1,2,3,4,4a,9,10,10a-octahydro-5-methyl-2-methylene-, [1S-(1.alpha.,4a.beta.,10a.alpha.)]-](/api/spectrum/EF0QZXQ1hFl/structure.png?h=300&w=458 "1-Phenanthrenepropanenitrile, 1,2,3,4,4a,9,10,10a-octahydro-5-methyl-2-methylene-, [1S-(1.alpha.,4a.beta.,10a.alpha.)]-")
