Dataset

distortionless enhancement with polarization transfer (DEPT)

Chemical Information

InChI	InChI=1S/C79H62N4O2/c1-84-79(85-2)77(61-47-55-73(56-48-61)82(67-35-19-7-20-36-67)68-37-21-8-22-38-68)75(59-43-51-71(52-44-59)80(63-27-11-3-12-28-63)64-29-13-4-14-30-64)76(60-45-53-72(54-46-60)81(65-31-15-5-16-32-65)66-33-17-6-18-34-66)78(79)62-49-57-74(58-50-62)83(69-39-23-9-24-40-69)70-41-25-10-26-42-70/h3-58H,1-2H3
SMILES	COC1(OC)C(=C(C(=C1c1ccc(cc1)N(c1ccccc1)c1ccccc1)c1ccc(cc1)N(c1ccccc1)c1ccccc1)c1ccc(cc1)N(c1ccccc1)c1ccccc1)c1ccc(cc1)N(c1ccccc1)c1ccccc1
InChI Key	TVLCMVFZPYWNLB-UHFFFAOYSA-N
Exact Mass	1099.363 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/TVLCMVFZPYWNLB-UHFFFAOYSA-N/CHMO0000596
License URL
Source	https://www.chemotion-repository.net/inchikey/TVLCMVFZPYWNLB-UHFFFAOYSA-N/CHMO0000596
Version
Author	Peter Bäuerle
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-11-19
Related Molecule

Field	Value
Measurement Technique	distortionless enhancement with polarization transfer
Measurement Variables	Date : 2025-08-23 Start time : 17:44:07 UTC Creator : Sylvia Vanderheiden-Schroen Label : ComP-27879 ID : 354234 Solvent : CDCl3 Temperature : 298.002552240982 K K Puls programme : deptsp90 Number of scans : 256 Instrument : Avance NEO 400 Name : TopSpin

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