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

*Links on SpectraBase are not permalinks.
7,12-Dimethyl-3-(morpholinosulfonyl)benzo[a]heptalene-2,4-diol
SpectraBase Compound ID 2Jv0lHCwOQa
InChI InChI=1S/C22H23NO5S/c1-14-7-8-17-18(20-15(2)5-3-4-6-16(14)20)13-19(24)22(21(17)25)29(26,27)23-9-11-28-12-10-23/h3-8,13,24-25H,9-12H2,1-2H3
InChIKey GXMVVNALXUUDHH-UHFFFAOYSA-N
Mol Weight 413.49 g/mol
Molecular Formula C22H23NO5S
Exact Mass 413.129694 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 HOikPdx6WK8
Name 7,12-Dimethyl-3-(morpholinosulfonyl)benzo[a]heptalene-2,4-diol
Alternate Name(s) 7,12-dimethyl-3-(4-morpholinylsulfonyl)benzo[a]heptalene-2,4-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO5S
InChI InChI=1S/C22H23NO5S/c1-14-7-8-17-18(20-15(2)5-3-4-6-16(14)20)13-19(24)22(21(17)25)29(26,27)23-9-11-28-12-10-23/h3-8,13,24-25H,9-12H2,1-2H3
InChIKey GXMVVNALXUUDHH-UHFFFAOYSA-N
Molecular Weight 413.488 g/mol
SMILES Oc1c(c(c2C=CC(=C3C(c2c1)=C(C=CC=C3)C)C)O)S(N1CCOCC1)(=O)=O
SPLASH splash10-03di-0140900000-153f10a9f8d953b0dc37
Source of Spectrum H-83-2396-5
Wiley ID 847224