Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C13H14N2O3S/c1-3-18-13-9(2)19-12(14-13)8-10-4-6-11(7-5-10)15(16)17/h4-9H,3H2,1-2H3/b12-8-
SMILES	CCOC1=N/C(=C/c2ccc(cc2)[N+](=O)[O-])/SC1C
InChI Key	MKZKXVUZVQMBSS-WQLSENKSSA-N
Molecular Formula	C13H14N2O3S
Exact Mass	278.327 g/mol

Data and Resources

• infrared absorption spectroscopy (IR)HTML
  Explore

  • More information
  • Go to resource

• infrared-absorption...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/MKZKXVUZVQMBSS-WQLSENKSSA-N/CHMO0000630
License URL
Source	https://www.chemotion-repository.net/inchikey/MKZKXVUZVQMBSS-WQLSENKSSA-N/CHMO0000630
Version
Author	Eric Täuscher
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T01:50:49.486480
MetadataModified	2024-09-08T01:50:49.486485
MetadataPublished	2023-11-07

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.