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2-[(12'-Oxo-12H-11'-oxa-16'-thiacyclopenta[a]phenanthren-17'-ylamino)methylene]-cyclohexane-1,3-dione
SpectraBase Compound ID 6tIKBFii6NR
InChI InChI=1S/C22H15NO4S/c24-17-6-3-7-18(25)15(17)10-23-21-19-16(11-28-21)14-9-8-12-4-1-2-5-13(12)20(14)27-22(19)26/h1-2,4-5,8-11,23H,3,6-7H2
InChIKey UUBULWRQSTUICH-UHFFFAOYSA-N
Mol Weight 389.43 g/mol
Molecular Formula C22H15NO4S
Exact Mass 389.072179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jtVdTHmCQm
Name 2-[(12'-Oxo-12H-11'-oxa-16'-thiacyclopenta[a]phenanthren-17'-ylamino)methylene]-cyclohexane-1,3-dione
Alternate Name(s) 2-{[(11-oxo-11H-benzo[h]thieno[3,4-c]chromen-1-yl)amino]methylene}-1,3-cyclohexanedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H15NO4S
InChI InChI=1S/C22H15NO4S/c24-17-6-3-7-18(25)15(17)10-23-21-19-16(11-28-21)14-9-8-12-4-1-2-5-13(12)20(14)27-22(19)26/h1-2,4-5,8-11,23H,3,6-7H2
InChIKey UUBULWRQSTUICH-UHFFFAOYSA-N
Molecular Weight 389.425 g/mol
SMILES N(C=C1C(=O)CCCC1=O)c1c2c(-c3ccc4c(c3OC2=O)cccc4)cs1
SPLASH splash10-014r-2396000000-0809a0b3003f2477e08e
Source of Spectrum AJ-43-564-23
Wiley ID 1593967