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3-(Cyclohexylamino)-2,7-bis(cyclohexylimino)-4-(4-nitrophenyl)-5H-furo[3,4-b]pyran-5-one
SpectraBase Compound ID EicKOc6JFvs
InChI InChI=1S/C31H38N4O5/c36-31-26-25(20-16-18-24(19-17-20)35(37)38)27(32-21-10-4-1-5-11-21)29(33-22-12-6-2-7-13-22)39-28(26)30(40-31)34-23-14-8-3-9-15-23/h16-19,21-23,32H,1-15H2/b33-29-,34-30+
InChIKey YJYOYMQSBHYGJR-HKQZHLORSA-N
Mol Weight 546.7 g/mol
Molecular Formula C31H38N4O5
Exact Mass 546.28422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7JMeNw5nn0f
Name 3-(Cyclohexylamino)-2,7-bis(cyclohexylimino)-4-(4-nitrophenyl)-5H-furo[3,4-b]pyran-5-one
Alternate Name(s) (2Z,7E)-3-(cyclohexylamino)-2,7-bis(cyclohexylimino)-4-(4-nitrophenyl)-2H-furo[3,4-b]pyran-5(7H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H38N4O5
InChI InChI=1S/C31H38N4O5/c36-31-26-25(20-16-18-24(19-17-20)35(37)38)27(32-21-10-4-1-5-11-21)29(33-22-12-6-2-7-13-22)39-28(26)30(40-31)34-23-14-8-3-9-15-23/h16-19,21-23,32H,1-15H2/b33-29-,34-30+
InChIKey YJYOYMQSBHYGJR-HKQZHLORSA-N
Molecular Weight 546.668 g/mol
SMILES N(C1=C(C2=C(\C(=N/C3CCCCC3)OC2=O)O\C1=N\C1CCCCC1)c1ccc(N(=O)=O)cc1)C1CCCCC1
SPLASH splash10-0a5a-9112150000-d3e55d26588a9af3fba8
Source of Spectrum HC-49-972-3f
Wiley ID 1739467