| SpectraBase Spectrum ID |
2qmFqsPTQGD |
| Name |
(+-)-(1.alpha.,2a.alpha.,8b.alpha.)-2a-Hydroxy-1,2,2a,3,4,8b-hexahydrocyclobuta[a]naphthalene-1-carbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13NO |
| InChI |
InChI=1S/C13H13NO/c14-8-10-7-13(15)6-5-9-3-1-2-4-11(9)12(10)13/h1-4,10,12,15H,5-7H2/t10-,12+,13-/m0/s1 |
| InChIKey |
YXUZFXVBWCKAQD-UHTWSYAYSA-N |
| Molecular Weight |
199.253 g/mol |
| SMILES |
O[C@]12[C@](c3ccccc3CC2)([H])[C@@](C1)(C#N)[H] |
| SPLASH |
splash10-0002-0900000000-3c4767168ddee2376394 |
| Source of Spectrum |
KC-0-56-5 |
| Synonyms |
(1R,2aS,8bR)-2a-hydroxy-1,2,2a,3,4,8b-hexahydrocyclobuta[a]naphthalene-1-carbonitrile |
| Wiley ID |
782940 |
![(+-)-(1.alpha.,2a.alpha.,8b.alpha.)-2a-Hydroxy-1,2,2a,3,4,8b-hexahydrocyclobuta[a]naphthalene-1-carbonitrile](/api/spectrum/2qmFqsPTQGD/structure.png?h=300&w=458 "(+-)-(1.alpha.,2a.alpha.,8b.alpha.)-2a-Hydroxy-1,2,2a,3,4,8b-hexahydrocyclobuta[a]naphthalene-1-carbonitrile")
