| SpectraBase Spectrum ID |
HQFD9hfSSAa |
| Name |
Cyclobuta[A]phenanthrene, D-norandrostan-16-ol deriv. |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
262.229665585 u |
| Formula |
C18H30O |
| InChI |
InChI=1S/C18H30O/c1-17-9-4-3-5-12(17)6-7-13-14(17)8-10-18(2)15(13)11-16(18)19/h12-16,19H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,17+,18-/m1/s1 |
| InChIKey |
LZYQBHDBYYENES-YSJMIEIKSA-N |
| Molecular Weight |
262.437 g/mol |
| SMILES |
[C@@]12([C@](CC[C@]3([C@]2(CC[C@@]2([C@]3(C)CCCC2)[H])[H])[H])(C)[C@@](C1)(O)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.835863 |
![Cyclobuta[a]phenanthrene, D-norandrostan-16-ol deriv.](/api/spectrum/HQFD9hfSSAa/structure.png?h=300&w=458 "Cyclobuta[a]phenanthrene, D-norandrostan-16-ol deriv.")
