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2-(3H-Benzo[c]isoxazol-1-ylmethyl)-malononitrile
SpectraBase Compound ID DMuFacVjQu3
InChI InChI=1S/C11H9N3O/c12-5-9(6-13)7-14-11-4-2-1-3-10(11)8-15-14/h1-4,9H,7-8H2
InChIKey MNUFCBYJVJYKEQ-UHFFFAOYSA-N
Mol Weight 199.21 g/mol
Molecular Formula C11H9N3O
Exact Mass 199.074562 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ShbCVvTyJH
Name 2-(3H-Benzo[c]isoxazol-1-ylmethyl)-malononitrile
Alternate Name(s) 2-(2,1-Benzisoxazol-1(3H)-ylmethyl)malononitrile 2-(3H-2,1-benzoxazol-1-ylmethyl)propanedinitrile 2-(3H-anthranil-1-ylmethyl)malononitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9N3O
InChI InChI=1S/C11H9N3O/c12-5-9(6-13)7-14-11-4-2-1-3-10(11)8-15-14/h1-4,9H,7-8H2
InChIKey MNUFCBYJVJYKEQ-UHFFFAOYSA-N
Molecular Weight 199.213 g/mol
SMILES C(#N)C(CN1OCc2ccccc12)C#N
SPLASH splash10-0le9-9500000000-caf82df94d8f930d373d
Wiley ID 1481611