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2-(4-Benzyloxy-3-iodo-5-methoxy-benzylidene)-malononitrile
SpectraBase Compound ID 4cRrpoO55Wz
InChI InChI=1S/C18H13IN2O2/c1-22-17-9-14(7-15(10-20)11-21)8-16(19)18(17)23-12-13-5-3-2-4-6-13/h2-9H,12H2,1H3
InChIKey CPUOXPBDDQATES-UHFFFAOYSA-N
Mol Weight 416.22 g/mol
Molecular Formula C18H13IN2O2
Exact Mass 416.002173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZsesDJcllw
Name 2-(4-Benzyloxy-3-iodo-5-methoxy-benzylidene)-malononitrile
CAS Registry Number 303784-81-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13IN2O2
InChI InChI=1S/C18H13IN2O2/c1-22-17-9-14(7-15(10-20)11-21)8-16(19)18(17)23-12-13-5-3-2-4-6-13/h2-9H,12H2,1H3
InChIKey CPUOXPBDDQATES-UHFFFAOYSA-N
Molecular Weight 416.218 g/mol
SMILES c1(c(cc(C=C(C#N)C#N)cc1I)OC)OCc1ccccc1
SPLASH splash10-0006-9100000000-57fe9a2f5cd6e3d5fce7
Synonyms 2-(4-benzoxy-3-iodo-5-methoxy-benzylidene)malononitrile 2-[(3-iodanyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]propanedinitrile 2-[(3-iodo-5-methoxy-4-phenylmethoxyphenyl)methylidene]propanedinitrile 2-[(4-benzyloxy-3-iodo-5-methoxy-phenyl)methylene]propanedinitrile
Wiley ID 1459145