For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
7-{[2-(Dimethylamino)ethyl]aminomethyl}-1,4-dihydropyridazino[3,4-c]psoralen-2-carboxylic acid methyl ester
SpectraBase Compound ID GF0lHvmP1eB
InChI InChI=1S/C20H22N4O5/c1-24(2)6-5-21-10-14-17-11(4-7-28-17)8-13-12-9-15(19(25)27-3)22-23-16(12)20(26)29-18(13)14/h4,7-8,21,23H,5-6,9-10H2,1-3H3
InChIKey VLGYKTKVWJQWGP-UHFFFAOYSA-N
Mol Weight 398.42 g/mol
Molecular Formula C20H22N4O5
Exact Mass 398.15902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6ad1Cvl5s1m
Name 7-{[2-(Dimethylamino)ethyl]aminomethyl}-1,4-dihydropyridazino[3,4-c]psoralen-2-carboxylic acid methyl ester
Alternate Name(s) Methyl 7-({[2-(dimethylamino)ethyl]amino}methyl)-5-oxo-1,5-dihydro-4H-furo[3',2':6,7]chromeno[3,4-c]pyridazine-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N4O5
InChI InChI=1S/C20H22N4O5/c1-24(2)6-5-21-10-14-17-11(4-7-28-17)8-13-12-9-15(19(25)27-3)22-23-16(12)20(26)29-18(13)14/h4,7-8,21,23H,5-6,9-10H2,1-3H3
InChIKey VLGYKTKVWJQWGP-UHFFFAOYSA-N
Molecular Weight 398.419 g/mol
SMILES N(Cc1c2occc2cc2C3=C(C(Oc12)=O)NN=C(C3)C(=O)OC)CCN(C)C
SPLASH splash10-0a4i-9705000000-dfe461306f849937a2c6
Source of Spectrum KC-61-4809-13
Wiley ID 1629241