SpectraBase Spectrum ID |
1Ssb8mXnGa |
Name |
1-(Pent-4-en-1-yl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
211.110947431 u |
Formula |
C13H13N3 |
InChI |
InChI=1S/C13H13N3/c1-2-3-4-8-16-10-11(9-14)12-6-5-7-15-13(12)16/h2,5-7,10H,1,3-4,8H2 |
InChIKey |
MBDZFMBLMIKYSS-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
211.268 g/mol |
Nominal Mass |
211 u |
Quality |
993 |
Retention Index |
1742 |
SMILES |
C=12C(C(=CN2CCCC=C)C#N)=CC=CN1 |
SPLASH |
splash10-0a4i-2910000000-aea06e699de1f162ee40 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(pent-4-en-1-yl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile |
Technique |
GC/MS |
Wiley ID |
DD2024_021070 |