| SpectraBase Spectrum ID |
1fTHZ5xGtcZ |
| Name |
2-Phenanthrenol, tetradecahydro-1-(iodomethyl)-2,4b-dimethyl-, [1S-(1.alpha.,2.beta.,4a.beta.,4b.alpha.,8a.beta.,10a.alpha.)]- |
| Alternate Name(s) |
(1S,2S,4aS,4bS,8aR,10aR)-1-(iodomethyl)-2,4b-dimethyltetradecahydro-2-phenanthrenol
13-Hydroxy-15-iodomethyl-d,d-dinor-13,15-seco-5.alpha.-androstane |
| CAS Registry Number |
132088-04-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H29IO |
| InChI |
InChI=1S/C17H29IO/c1-16-9-4-3-5-12(16)6-7-13-14(16)8-10-17(2,19)15(13)11-18/h12-15,19H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17+/m1/s1 |
| InChIKey |
GQVKYFSUQNAPGQ-XDKXFUCDSA-N |
| Molecular Weight |
376.322 g/mol |
| SMILES |
O[C@]1(CC[C@@]2([C@@]3([C@@](CCCC3)([H])CC[C@]2([C@@]1(CI)[H])[H])C)[H])C |
| SPLASH |
splash10-001i-0090000000-0966df9ba46defb8d945 |
| Source of Spectrum |
KC-1990-2829-23 |
| Wiley ID |
1357520 |
![2-Phenanthrenol, tetradecahydro-1-(iodomethyl)-2,4b-dimethyl-, [1S-(1.alpha.,2.beta.,4a.beta.,4b.alpha.,8a.beta.,10a.alpha.)]-](/api/spectrum/1fTHZ5xGtcZ/structure.png?h=300&w=458 "2-Phenanthrenol, tetradecahydro-1-(iodomethyl)-2,4b-dimethyl-, [1S-(1.alpha.,2.beta.,4a.beta.,4b.alpha.,8a.beta.,10a.alpha.)]-")
