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(E)-3-{(1R,2R)-1-[Cyano-(methyl-phenyl-amino)-methyl]-1-methyl-indan-2-yl}-but-2-enenitrile
SpectraBase Compound ID 6pJYsiDxJaX
InChI InChI=1S/C23H23N3/c1-17(13-14-24)21-15-18-9-7-8-12-20(18)23(21,2)22(16-25)26(3)19-10-5-4-6-11-19/h4-13,21-22H,15H2,1-3H3/b17-13+/t21-,22?,23+/m1/s1
InChIKey BVLLVDVNRSNEEX-RTRRSSCGSA-N
Mol Weight 341.46 g/mol
Molecular Formula C23H23N3
Exact Mass 341.189198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ljDNKBaSyx
Name (E)-3-{(1R,2R)-1-[Cyano-(methyl-phenyl-amino)-methyl]-1-methyl-indan-2-yl}-but-2-enenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23N3
InChI InChI=1S/C23H23N3/c1-17(13-14-24)21-15-18-9-7-8-12-20(18)23(21,2)22(16-25)26(3)19-10-5-4-6-11-19/h4-13,21-22H,15H2,1-3H3/b17-13+/t21-,22?,23+/m1/s1
InChIKey BVLLVDVNRSNEEX-RTRRSSCGSA-N
Molecular Weight 341.458 g/mol
SMILES [C@@]1([C@](Cc2c1cccc2)(\C(=C\C#N)C)[H])(C(N(c1ccccc1)C)C#N)C
SPLASH splash10-0002-0902000000-2f65d0cf3f5f5bc58b36
Source of Spectrum KC-0-886-28
Synonyms (2E)-3-{(1R,2R)-1-[cyano(methylanilino)methyl]-1-methyl-2,3-dihydro-1H-inden-2-yl}-2-butenenitrile trans-3-{1-[Cyano(N-methylanilino)methyl]-2,3-dihydro-1-methylindan-2-yl}but-2-enenitrile
Wiley ID 783550