Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C17H21NO/c1-18(2)16-12-8-11-15(13-16)17(19)14-9-6-4-3-5-7-10-14/h3-4,8,10-13H,5-7,9H2,1-2H3/b4-3-,14-10+
SMILES	O=C(c1cccc(c1)N(C)C)C1=CCCC=CCC1
InChI Key	PBTXXVFXWAJEJI-QKKCAOIGSA-N
Molecular Formula	C17H21NO
Exact Mass	255.355 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/PBTXXVFXWAJEJI-QKKCAOIGSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/PBTXXVFXWAJEJI-QKKCAOIGSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:27:30.793705
MetadataModified	2024-09-07T15:38:22.823371
MetadataPublished	2019-06-27
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453691	PubChem
The data in this table is sourced from UniChem at EBI.