| SpectraBase Spectrum ID |
Cxhef5vS5T7 |
| Name |
2-[1-(3,4-dimethoxyphenyl)-4-keto-cyclohex-2-en-1-yl]acetonitrile |
| Alternate Name(s) |
2-[1-(3,4-dimethoxyphenyl)-4-oxidanylidene-cyclohex-2-en-1-yl]ethanenitrile
2-[1-(3,4-dimethoxyphenyl)-4-oxo-1-cyclohex-2-enyl]acetonitrile
2-[1-(3,4-dimethoxyphenyl)-4-oxo-cyclohex-2-en-1-yl]acetonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H17NO3 |
| InChI |
InChI=1S/C16H17NO3/c1-19-14-4-3-12(11-15(14)20-2)16(9-10-17)7-5-13(18)6-8-16/h3-5,7,11H,6,8-9H2,1-2H3 |
| InChIKey |
KPCOPTNSPDUHQK-UHFFFAOYSA-N |
| Molecular Weight |
271.316 g/mol |
| SMILES |
C1(C=CC(CC1)=O)(c1cc(OC)c(cc1)OC)CC#N |
| SPLASH |
splash10-001i-0090000000-ad25d82515da273a00a1 |
| Source of Spectrum |
KC-1991-1056-24 |
| Wiley ID |
1275355 |
![2-[1-(3,4-dimethoxyphenyl)-4-keto-cyclohex-2-en-1-yl]acetonitrile](/api/spectrum/Cxhef5vS5T7/structure.png?h=300&w=458 "2-[1-(3,4-dimethoxyphenyl)-4-keto-cyclohex-2-en-1-yl]acetonitrile")
