Molecule

nfdi4chem-mol5617 (Unknown Molecule)

Chemical Information

Molecular Image

InChI	InChI=1S/C17H22N6/c1-13(2)23(14(3)4)21-19-17-16(10-18)12-22(20-17)11-15-8-6-5-7-9-15/h5-9,12-14H,11H2,1-4H3/b21-19+
SMILES	N#Cc1cn(nc1/N=N/N(C(C)C)C(C)C)Cc1ccccc1
InChI Key	AONLLYWWGOIMLR-XUTLUUPISA-N
Exact Mass	310.397 g/mol

14 Related Dataset(s) ⌄

13C nuclear magnetic resonance spectroscopy (13C NMR)

13C nuclear magnetic resonance spectroscopy (13C NMR)

1H nuclear magnetic resonance spectroscopy (1H NMR)

1H nuclear magnetic resonance spectroscopy (1H NMR)

distortionless enhancement with polarization transfer (DEPT)

distortionless enhancement with polarization transfer (DEPT)

distortionless enhancement with polarization transfer (DEPT)

distortionless enhancement with polarization transfer (DEPT)

heteronuclear multiple bond coherence (HMBC)

heteronuclear single quantum coherence (HSQC)

infrared absorption spectroscopy (IR)

infrared absorption spectroscopy (IR)

mass spectrometry (MS)

mass spectrometry (MS)

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol5617
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
155928548	pubchem
The data in this table is sourced from UniChem at EBI.