Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C12H21O9P3/c1-16-22(13,17-2)10-7-11(23(14,18-3)19-4)9-12(8-10)24(15,20-5)21-6/h7-9H,1-6H3
SMILES COP(=O)(c1cc(cc(c1)P(=O)(OC)OC)P(=O)(OC)OC)OC
InChI Key SZWWJNWOTTYFSA-UHFFFAOYSA-N
Molecular Formula C12H21O9P3
Exact Mass 402.211 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SZWWJNWOTTYFSA-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/SZWWJNWOTTYFSA-UHFFFAOYSA-N/CHMO0000593
Version
Author Christoph Zippel
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T05:32:34.123605
MetadataModified 2024-09-07T21:03:14.890624
MetadataPublished 2022-01-10
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables