For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(E)-2-(1H-benzimidazol-2-yl)-3-(4-isoamoxy-3-methoxy-phenyl)acrylonitrile
SpectraBase Compound ID 6aBItXbpEv6
InChI InChI=1S/C22H23N3O2/c1-15(2)10-11-27-20-9-8-16(13-21(20)26-3)12-17(14-23)22-24-18-6-4-5-7-19(18)25-22/h4-9,12-13,15H,10-11H2,1-3H3,(H,24,25)/b17-12+
InChIKey KQZUKDVBZWRUEW-SFQUDFHCSA-N
Mol Weight 361.45 g/mol
Molecular Formula C22H23N3O2
Exact Mass 361.179027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7YRLBaPjNFd
Name (E)-2-(1H-benzimidazol-2-yl)-3-(4-isoamoxy-3-methoxy-phenyl)acrylonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23N3O2
InChI InChI=1S/C22H23N3O2/c1-15(2)10-11-27-20-9-8-16(13-21(20)26-3)12-17(14-23)22-24-18-6-4-5-7-19(18)25-22/h4-9,12-13,15H,10-11H2,1-3H3,(H,24,25)/b17-12+
InChIKey KQZUKDVBZWRUEW-SFQUDFHCSA-N
Molecular Weight 361.445 g/mol
SMILES [nH]1c2ccccc2nc1\C(=C\c1ccc(c(c1)OC)OCCC(C)C)C#N
SPLASH splash10-0006-9284000000-9404b3ca47bba90d1c59
Synonyms (E)-2-(1H-benzimidazol-2-yl)-3-(4-isopentyloxy-3-methoxy-phenyl)prop-2-enenitrile (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-propenenitrile (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enenitrile
Wiley ID 1442698