Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C33H42N10/c1-37-19-20-38(2)31(37)34-25-13-7-10-16-28(25)43(29-17-11-8-14-26(29)35-32-39(3)21-22-40(32)4)30-18-12-9-15-27(30)36-33-41(5)23-24-42(33)6/h7-18H,19-24H2,1-6H3
SMILES CN1CCN(C1=Nc1ccccc1N(c1ccccc1N=C1N(C)CCN1C)c1ccccc1N=C1N(C)CCN1C)C
InChI Key LWWLWWCXVVCWLP-UHFFFAOYSA-N
Molecular Formula C33H42N10
Exact Mass 578.754 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/LWWLWWCXVVCWLP-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/LWWLWWCXVVCWLP-UHFFFAOYSA-N/CHMO0000630
Version
Author Tobias Seitz
Maintainer Chemotion Repository
Language english
MetadataCreated 2025-01-29T10:33:22.084271
MetadataModified 2025-01-29T16:25:50.712497
MetadataPublished 2024-11-15
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