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Spiro[cyclohexane-1,2'(3'H)-quinoxalin]-3'-one, 1',4'-dihydro-6',8'-dinitro-
SpectraBase Compound ID CY46damuWh5
InChI InChI=1S/C13H14N4O5/c18-12-13(4-2-1-3-5-13)15-11-9(14-12)6-8(16(19)20)7-10(11)17(21)22/h6-7,15H,1-5H2,(H,14,18)
InChIKey PYHSEQJTLYFGPJ-UHFFFAOYSA-N
Mol Weight 306.28 g/mol
Molecular Formula C13H14N4O5
Exact Mass 306.09642 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5rwXnV6dRBf
Name Spiro[cyclohexane-1,2'(3'H)-quinoxalin]-3'-one, 1',4'-dihydro-6',8'-dinitro-
CAS Registry Number 130138-29-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N4O5
InChI InChI=1S/C13H14N4O5/c18-12-13(4-2-1-3-5-13)15-11-9(14-12)6-8(16(19)20)7-10(11)17(21)22/h6-7,15H,1-5H2,(H,14,18)
InChIKey PYHSEQJTLYFGPJ-UHFFFAOYSA-N
Molecular Weight 306.278 g/mol
SMILES N1C2(C(Nc3c1c(N(=O)=O)cc(N(=O)=O)c3)=O)CCCCC2
SPLASH splash10-0a4i-2195000000-d3ef20eb794f2f0202e9
Source of Spectrum H-73-969-5
Synonyms 1',2',3',4'-Tetrahydro-5',7'-dinitrospiro[cyclohexane-1,3'-quinoxalin]-2'-one 6',8'-dinitro-3',4'-dihydro-1'H-spiro[cyclohexane-1,2'-quinoxaline]-3'-one
Wiley ID 1307721