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3-( 1',2'-Dimethylindol-3'-yl)-4-nitrobutyronitrile
SpectraBase Compound ID 3ceNBnLfsHS
InChI InChI=1S/C14H15N3O2/c1-10-14(11(7-8-15)9-17(18)19)12-5-3-4-6-13(12)16(10)2/h3-6,11H,7,9H2,1-2H3
InChIKey IYZGMHIFVCSCSW-UHFFFAOYSA-N
Mol Weight 257.29 g/mol
Molecular Formula C14H15N3O2
Exact Mass 257.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 543ZTXhyez3
Name 3-( 1',2'-Dimethylindol-3'-yl)-4-nitrobutyronitrile
Alternate Name(s) 3-(1,2-dimethyl-1H-indol-3-yl)-4-nitrobutanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15N3O2
InChI InChI=1S/C14H15N3O2/c1-10-14(11(7-8-15)9-17(18)19)12-5-3-4-6-13(12)16(10)2/h3-6,11H,7,9H2,1-2H3
InChIKey IYZGMHIFVCSCSW-UHFFFAOYSA-N
Molecular Weight 257.293 g/mol
SMILES c1([n](c2ccccc2c1C(CN(=O)=O)CC#N)C)C
SPLASH splash10-00di-0910000000-8ea5ce8bba232f20e3ed
Source of Spectrum D8-327-356-23
Wiley ID 1515229