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Cpd. 4d-1
SpectraBase Compound ID CTVwORiWe8I
InChI InChI=1S/C23H19N5O4/c1-31-16-7-3-14(4-8-16)19-18(11-24)22(27)23(12-25,13-26)20(21(19)28(29)30)15-5-9-17(32-2)10-6-15/h3-10,19-21H,27H2,1-2H3/t19-,20+,21-/m0/s1
InChIKey JGNVHGQLKVWGPC-HBMCJLEFSA-N
Mol Weight 429.44 g/mol
Molecular Formula C23H19N5O4
Exact Mass 429.143704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 14gxi9DObVF
Name Cpd. 4d-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H19N5O4
InChI InChI=1S/C23H19N5O4/c1-31-16-7-3-14(4-8-16)19-18(11-24)22(27)23(12-25,13-26)20(21(19)28(29)30)15-5-9-17(32-2)10-6-15/h3-10,19-21H,27H2,1-2H3/t19-,20+,21-/m0/s1
InChIKey JGNVHGQLKVWGPC-HBMCJLEFSA-N
Molecular Weight 429.436 g/mol
SMILES NC1=C(C#N)[C@@]([C@@]([C@](C1(C#N)C#N)(c1ccc(cc1)OC)[H])(N(=O)=O)[H])(c1ccc(cc1)OC)[H]
SPLASH splash10-0ufr-0590000000-050c290bd357eab8a50b
Source of Spectrum F5-6-3619-4d-1
Synonyms (4S,5S,6S)-2-Amino-4,6-bis-(4-methoxy-phenyl)-5-nitro-cyclohex-2-ene-1,1,3-tricarbonitrile 1-Amino-2,6,6-tricyano-3,5-bis(p-methoxyphenyl)-4-nitrocyclohex-1-ene (1'S,2'S,3'S)-5'-amino-4,4''-dimethoxy-2'-nitro-2',3'-dihydro-[1,1':3',1''-terphenyl]-4',4',6'(1'H)-tricarbonitrile
Wiley ID 1733683