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

*Links on SpectraBase are not permalinks.
Ethyl Ester of (S)-2-(2,5-Dimethyl-1H-pyrrol-1-yl)-3-methylbutanoic Acid
SpectraBase Compound ID 2jKHf4xfL0G
InChI InChI=1S/C13H21NO2/c1-6-16-13(15)12(9(2)3)14-10(4)7-8-11(14)5/h7-9,12H,6H2,1-5H3/t12-/m0/s1
InChIKey FMDVBVIGHJERCC-LBPRGKRZSA-N
Mol Weight 223.32 g/mol
Molecular Formula C13H21NO2
Exact Mass 223.157229 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 8jSXp6f91iD
Name Ethyl Ester of (S)-2-(2,5-Dimethyl-1H-pyrrol-1-yl)-3-methylbutanoic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21NO2
InChI InChI=1S/C13H21NO2/c1-6-16-13(15)12(9(2)3)14-10(4)7-8-11(14)5/h7-9,12H,6H2,1-5H3/t12-/m0/s1
InChIKey FMDVBVIGHJERCC-LBPRGKRZSA-N
Molecular Weight 223.316 g/mol
SMILES c1([n](c(cc1)C)[C@](C(=O)OCC)(C(C)C)[H])C
SPLASH splash10-0006-9410000000-9d4f146c39a51b49b6fa
Source of Spectrum J-47-190-1c
Synonyms Ethyl Ester of 2-(2,5-Dimethyl-1H-pyrrol-1-yl)-3-methylbutanoic Acid (S)-ethyl 2-(2,5-dimethyl-1H-pyrrol-1-yl)-3-methylbutanoate
Wiley ID 1734056