| SpectraBase Spectrum ID |
JKVan9Pe8Mm |
| Name |
trans-1-Acetoxy-4-(N-p-toluenesulfonyl-N-prop-2-ynyl)aminocyclohex-2-ene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21NO4S |
| InChI |
InChI=1S/C18H21NO4S/c1-4-13-19(16-7-9-17(10-8-16)23-15(3)20)24(21,22)18-11-5-14(2)6-12-18/h1,5-7,9,11-12,16-17H,8,10,13H2,2-3H3/t16-,17-/m0/s1 |
| InChIKey |
XFLFNHBXOIZAKT-IRXDYDNUSA-N |
| Molecular Weight |
347.429 g/mol |
| SMILES |
[C@@]1(N(S(c2ccc(cc2)C)(=O)=O)CC#C)(C=C[C@](OC(=O)C)(CC1)[H])[H] |
| SPLASH |
splash10-000f-9850000000-b719d97429ee915e9f9d |
| Source of Spectrum |
F-52-11495-34 |
| Synonyms |
(1R,4R)-4-[[(4-methylphenyl)sulfonyl](2-propynyl)amino]-2-cyclohexen-1-yl acetate |
| Wiley ID |
798360 |
