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3'-(3-hydroxyphenyl)-4-methyl-spiro[1H-1,4-benzodiazepine-3,2'-oxirane]-2,5-dione
SpectraBase Compound ID 3SBsocg0UUW
InChI InChI=1S/C17H14N2O4/c1-19-15(21)12-7-2-3-8-13(12)18-16(22)17(19)14(23-17)10-5-4-6-11(20)9-10/h2-9,14,20H,1H3,(H,18,22)
InChIKey BDDNYDPRCCDQQJ-UHFFFAOYSA-N
Mol Weight 310.31 g/mol
Molecular Formula C17H14N2O4
Exact Mass 310.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lu7UzuFe9E5
Name 3'-(3-hydroxyphenyl)-4-methyl-spiro[1H-1,4-benzodiazepine-3,2'-oxirane]-2,5-dione
Alternate Name(s) 3'-(3-hydroxyphenyl)-4-methyl-spiro[1H-1,4-benzodiazepine-3,2'-oxirane]-2,5-quinone Cyclopenol
CAS Registry Number 20007-85-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O4
InChI InChI=1S/C17H14N2O4/c1-19-15(21)12-7-2-3-8-13(12)18-16(22)17(19)14(23-17)10-5-4-6-11(20)9-10/h2-9,14,20H,1H3,(H,18,22)
InChIKey BDDNYDPRCCDQQJ-UHFFFAOYSA-N
Molecular Weight 310.309 g/mol
SMILES Oc1cccc(C2C3(C(=O)Nc4c(C(N3C)=O)cccc4)O2)c1
SPLASH splash10-0w29-0693000000-95a6f816cb162ee4bbed
Source of Spectrum X2-51-72-5
Wiley ID 1602532