Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C12H17N3O8/c1-5(16)20-9-8(4-14-15-13)23-12(19)11(22-7(3)18)10(9)21-6(2)17/h8-12,19H,4H2,1-3H3/t8?,9-,10+,11?,12?/m1/s1
SMILES	[N-]=[N+]=NCC1OC(O)C([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C
InChI Key	MUTUZTFDNMUQCN-VHDMFRCESA-N
Molecular Formula	C12H17N3O8
Exact Mass	331.279 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/MUTUZTFDNMUQCN-VHDMFRCESA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/MUTUZTFDNMUQCN-VHDMFRCESA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:20:50.545288
MetadataModified	2024-09-07T15:28:19.258683
MetadataPublished	2019-06-27

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

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