| SpectraBase Spectrum ID |
8Y8KYF4mQ7q |
| Name |
2-Amino-4-(4-butoxyphenyl)-7,8-dihydro-7,7-dimethyl-5(6H)-oxo-4H-benzo[B]pyran-3-carbonitrile |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
366.194342702 u |
| Formula |
C22H26N2O3 |
| InChI |
InChI=1S/C22H26N2O3/c1-4-5-10-26-15-8-6-14(7-9-15)19-16(13-23)21(24)27-18-12-22(2,3)11-17(25)20(18)19/h6-9,19H,4-5,10-12,24H2,1-3H3 |
| InChIKey |
VXPKTTQZNFSDDV-UHFFFAOYSA-N |
| Molecular Weight |
366.461 g/mol |
| SMILES |
C1C2=C(C(CC1(C)C)=O)C(C(=C(O2)N)C#N)C1=CC=C(C=C1)OCCCC |
![2-Amino-4-(4-butoxyphenyl)-7,8-dihydro-7,7-dimethyl-5(6H)-oxo-4H-benzo[b]pyran-3-carbonitrile](/api/spectrum/8Y8KYF4mQ7q/structure.png?h=300&w=458 "2-Amino-4-(4-butoxyphenyl)-7,8-dihydro-7,7-dimethyl-5(6H)-oxo-4H-benzo[b]pyran-3-carbonitrile")
