Dataset

Bis (2,6-diisopropylphenyl)-carbodiimide

This MassBank record with Accession MSBNK-Athens_Univ-AU505808 contains the MS2 mass spectrum of Bis (2,6-diisopropylphenyl)-carbodiimide with the InChIkey XLDBGFGREOMWSL-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C25H34N2/c1-16(2)20-11-9-12-21(17(3)4)24(20)26-15-27-25-22(18(5)6)13-10-14-23(25)19(7)8/h9-14,16-19H,1-8H3
SMILES CC(C)C1=C(C(=CC=C1)C(C)C)N=C=NC2=C(C=CC=C2C(C)C)C(C)C
InChI Key XLDBGFGREOMWSL-UHFFFAOYSA-N
Molecular Formula C25H34N2
Exact Mass 362.272 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU505808
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:50:19.440400
MetadataModified 2024-01-11T09:50:19.598397
MetadataPublished 2021-04-20
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
J299.128D Nikkaji
YOFJAF CCDC
75100 PubChem
YPK27Z98PL FDA SRS
DTXSID5051862 EPA CompTox Dashboard
MCULE-5666921352 Mcule
ZINC000008637108 ZINC
CB1347186 ChemicalBook
5808742 eMolecules
SCHEMBL134760 SureChEMBL
14779172 PubChem: Thomson Pharma
2162-74-5 ACToR
The data in this table is sourced from UniChem at EBI.