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

*Links on SpectraBase are not permalinks.
Indole-3-butyric acid
SpectraBase Compound ID 1SEcCtlnGSq
InChI InChI=1S/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)
InChIKey JTEDVYBZBROSJT-UHFFFAOYSA-N
Mol Weight 203.24 g/mol
Molecular Formula C12H13NO2
Exact Mass 203.094629 g/mol

Raman Spectrum

Raman Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID KdC5NfkxNfs
Name Indole-3-butyric acid
Source of Sample Cayman Chemical Company
Catalog Number 22591
Lot Number 0512206-1
Acronyms IBA
CAS Registry Number 133-32-4
Cell Type NMR tube
Compound Type Pure
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO2
IUPAC Name 1H-Indole-3-butanoic acid
InChI InChI=1S/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)
InChIKey JTEDVYBZBROSJT-UHFFFAOYSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 903 mW
Raman Laser Source Nd:YAG
SMILES [nH]1c2ccccc2c(CCCC(O)=O)c1
Scans Performed 2048
Source of Spectrum Forensic Spectral Research
Synonyms NSC 3130
Technique FT-Raman