| SpectraBase Spectrum ID |
KaykwpJVbxd |
| Name |
16,17-seco-3-Methoxyestra-1,3,5(10)-trien-17-al-(p-Cyanophenyl)-hydrazone |
| Alternate Name(s) |
4-[(2E)-2-[[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methylidene]hydrazinyl]benzonitrile
4-[(2E)-2-[[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methylene]hydrazino]benzonitrile
4-[(2E)-2-[[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methylidene]hydrazinyl]benzenecarbonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H33N3O |
| InChI |
InChI=1S/C27H33N3O/c1-4-5-26-25-12-8-20-16-22(31-3)11-13-23(20)24(25)14-15-27(26,2)18-29-30-21-9-6-19(17-28)7-10-21/h6-7,9-11,13,16,18,24-26,30H,4-5,8,12,14-15H2,1-3H3/b29-18+/t24-,25-,26+,27-/m1/s1 |
| InChIKey |
XJJUQLADQGGSRX-HEJCHJQHSA-N |
| Molecular Weight |
415.581 g/mol |
| SMILES |
N(\N=C\[C@@]1([C@]([C@]2([C@@](c3c(CC2)cc(cc3)OC)(CC1)[H])[H])(CCC)[H])C)c1ccc(C#N)cc1 |
| SPLASH |
splash10-00kb-0090300000-19cc9da8675c1946369b |
| Source of Spectrum |
U1-2009-3548-10g |
| Wiley ID |
1696941 |
