| SpectraBase Spectrum ID |
JZa5yTSkYfx |
| Name |
16,17-seco-3-Methoxyestra-1,3,5(10)-trien-17-al-(p-Chlorophenyl)-hydrazone |
| Alternate Name(s) |
N-[(E)-[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methylideneamino]-4-chloroaniline
N-[(E)-[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methyleneamino]-4-chloro-aniline
N-[(E)-[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methylideneamino]-4-chloranyl-aniline |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H33ClN2O |
| InChI |
InChI=1S/C26H33ClN2O/c1-4-5-25-24-12-6-18-16-21(30-3)11-13-22(18)23(24)14-15-26(25,2)17-28-29-20-9-7-19(27)8-10-20/h7-11,13,16-17,23-25,29H,4-6,12,14-15H2,1-3H3/b28-17+/t23-,24-,25+,26-/m1/s1 |
| InChIKey |
XQNOLXCTTFVBGB-FQSHPURFSA-N |
| Molecular Weight |
425.016 g/mol |
| SMILES |
N(\N=C\[C@@]1([C@]([C@]2([C@@](c3c(CC2)cc(cc3)OC)(CC1)[H])[H])(CCC)[H])C)c1ccc(Cl)cc1 |
| SPLASH |
splash10-0002-0090600000-c86cab231c1a6d09b3d1 |
| Source of Spectrum |
U1-2009-3549-10j |
| Wiley ID |
1696891 |
