Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C8H12N2O3/c1-6(11)4-3-5-7(10-9)8(12)13-2/h3-5H2,1-2H3
SMILES	[N-]=[N+]=C(C(=O)OC)CCCC(=O)C
InChI Key	QOKCGDSBHFTLMZ-UHFFFAOYSA-N
Molecular Formula	C8H12N2O3
Exact Mass	184.192 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/QOKCGDSBHFTLMZ-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/QOKCGDSBHFTLMZ-UHFFFAOYSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:12:53.473428
MetadataModified	2024-09-07T15:16:34.354277
MetadataPublished	2019-06-27
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453469	PubChem
The data in this table is sourced from UniChem at EBI.