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Propanedinitrile, (2-methoxy-9H-1,8-[1]propen[1]yl[3]ylidene-7H-benzocyclohepten-7-ylidene)-, (.+-.)-
SpectraBase Compound ID H7NjFe79DOv
InChI InChI=1S/C18H12N2O/c1-21-18-8-6-12-5-7-15(14(10-19)11-20)13-3-2-4-16(18)17(12)9-13/h2-8H,9H2,1H3
InChIKey TXOSOJXNXQKUOB-UHFFFAOYSA-N
Mol Weight 272.31 g/mol
Molecular Formula C18H12N2O
Exact Mass 272.094963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AD8gEuDLOl
Name Propanedinitrile, (2-methoxy-9H-1,8-[1]propen[1]yl[3]ylidene-7H-benzocyclohepten-7-ylidene)-, (.+-.)-
CAS Registry Number 84984-40-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12N2O
InChI InChI=1S/C18H12N2O/c1-21-18-8-6-12-5-7-15(14(10-19)11-20)13-3-2-4-16(18)17(12)9-13/h2-8H,9H2,1H3
InChIKey TXOSOJXNXQKUOB-UHFFFAOYSA-N
Molecular Weight 272.307 g/mol
SMILES C1(C=2Cc3c(c(OC)ccc3C=C1)C=CC2)=C(C#N)C#N
SPLASH splash10-05fr-0090000000-07903c1dc84a52180535
Source of Spectrum AH-113-1165-0
Synonyms 2-[2-methoxytricyclo[7.3.2.0(5,13)]tetradeca-1(13),2,4,6,9,11-hexaen-8-ylidene]malononitrile 7-Dicyanomethylene-7H-2-methoxy-9H-1,8-(1'-propen-1'-yl-3'-yliden)-benzo-cycloheptane 9H-1,8-[1]propen[1]yl[3]ylidene-7H-benzocycloheptene, propanedinitrile deriv.
Wiley ID 1276536