| SpectraBase Spectrum ID |
C1Bc11qdNlK |
| Name |
1-(N-Carbomethoxy-N-methylaminoethyl)-3,4-dimethoxy-6,7-methylenedioxyphenanthrene |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.152537459 u |
| Formula |
C22H23NO6 |
| InChI |
InChI=1S/C22H23NO6/c1-23(22(24)27-4)8-7-14-10-19(25-2)21(26-3)20-15(14)6-5-13-9-17-18(11-16(13)20)29-12-28-17/h5-6,9-11H,7-8,12H2,1-4H3 |
| InChIKey |
ZJRNNIGREMDTTQ-UHFFFAOYSA-N |
| Molecular Weight |
397.427 g/mol |
| SMILES |
C1(=C2C=CC=3C=C4C(=CC3C2=C(OC)C(OC)=C1)OCO4)CCN(C)C(OC)=O |
