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5-Butyl-9-methoxy-7-nitro-6-benzo[b][1,4]benzoxazepinone
SpectraBase Compound ID 3Tl8u4duttc
InChI InChI=1S/C18H18N2O5/c1-3-4-9-19-13-7-5-6-8-15(13)25-16-11-12(24-2)10-14(20(22)23)17(16)18(19)21/h5-8,10-11H,3-4,9H2,1-2H3
InChIKey XKQSPGFVKYRMCI-UHFFFAOYSA-N
Mol Weight 342.35 g/mol
Molecular Formula C18H18N2O5
Exact Mass 342.121572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oLpvTPCe6s
Name 5-Butyl-9-methoxy-7-nitro-6-benzo[b][1,4]benzoxazepinone
Alternate Name(s) 5-Butyl-9-methoxy-7-nitro-benzo[b][1,4]benzoxazepin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2O5
InChI InChI=1S/C18H18N2O5/c1-3-4-9-19-13-7-5-6-8-15(13)25-16-11-12(24-2)10-14(20(22)23)17(16)18(19)21/h5-8,10-11H,3-4,9H2,1-2H3
InChIKey XKQSPGFVKYRMCI-UHFFFAOYSA-N
Molecular Weight 342.351 g/mol
SMILES c12Oc3c(C(N(c2cccc1)CCCC)=O)c(cc(c3)OC)N(=O)=O
SPLASH splash10-0a5d-0944000000-872f54684f1427397b44
Source of Spectrum F-70-9375-9
Wiley ID 1597753