| SpectraBase Spectrum ID |
7efEx1A5NwO |
| Name |
3-[(p-Methylphenyl)sulfonyl]tricyclo[4.2.1.0(2,5)]nona-3,7-diene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H16O2S |
| InChI |
InChI=1S/C16H16O2S/c1-10-2-6-13(7-3-10)19(17,18)15-9-14-11-4-5-12(8-11)16(14)15/h2-7,9,11-12,14,16H,8H2,1H3/t11-,12+,14+,16-/m1/s1 |
| InChIKey |
BVMFAAUVLJZFSR-UHFFFAOYSA-N |
| Molecular Weight |
272.362 g/mol |
| SMILES |
C1(S(c2ccc(cc2)C)(=O)=O)=C[C@@]2([C@]1([C@]1(C=C[C@@]2(C1)[H])[H])[H])[H] |
| SPLASH |
splash10-014i-0900000000-2a1fd66b52812f4afda4 |
| Source of Spectrum |
F-68-2171-21 |
| Wiley ID |
1708008 |
![3-[(p-Methylphenyl)sulfonyl]tricyclo[4.2.1.0(2,5)]nona-3,7-diene](/api/spectrum/7efEx1A5NwO/structure.png?h=300&w=458 "3-[(p-Methylphenyl)sulfonyl]tricyclo[4.2.1.0(2,5)]nona-3,7-diene")
