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(2Z)-4-Azido-3-(2-oxo-2H-chromen-3-yl)but-2-enenitrile
SpectraBase Compound ID KK3fm5hSgmQ
InChI InChI=1S/C13H8N4O2/c14-6-5-10(8-16-17-15)11-7-9-3-1-2-4-12(9)19-13(11)18/h1-5,7H,8H2/b10-5+
InChIKey VXXRXTWFNOZCMK-BJMVGYQFSA-N
Mol Weight 252.23 g/mol
Molecular Formula C13H8N4O2
Exact Mass 252.064726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Ra4fjl4a0
Name (2Z)-4-Azido-3-(2-oxo-2H-chromen-3-yl)but-2-enenitrile
Alternate Name(s) (Z)-4-azido-3-(2-oxo-1-benzopyran-3-yl)-2-butenenitrile (Z)-4-azido-3-(2-oxochromen-3-yl)but-2-enenitrile (Z)-4-azido-3-(2-oxidanylidenechromen-3-yl)but-2-enenitrile
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Formula C13H8N4O2
InChI InChI=1S/C13H8N4O2/c14-6-5-10(8-16-17-15)11-7-9-3-1-2-4-12(9)19-13(11)18/h1-5,7H,8H2/b10-5+
InChIKey VXXRXTWFNOZCMK-BJMVGYQFSA-N
Molecular Weight 252.233 g/mol
SMILES C=1(C(Oc2c(C1)cccc2)=O)\C(=C\C#N)CN=[N+]=[N-]
SPLASH splash10-02ft-0960000000-2ebeca6e37a8f5fc2536
Source of Spectrum Y-48-1262-11c
Wiley ID 1704456