Dataset

electron ionisation mass spectrometry (EI-MS)

Chemical Info

InChI	InChI=1S/C8H12NO3P/c1-11-13(10,12-2)8-5-3-7(9)4-6-8/h3-6H,9H2,1-2H3
SMILES	COP(=O)(c1ccc(cc1)N)OC
InChI Key	CXGDPEBXNOAMCA-UHFFFAOYSA-N
Molecular Formula	C8H12NO3P
Exact Mass	201.160 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/CXGDPEBXNOAMCA-UHFFFAOYSA-N/CHMO0000480
License URL
Source	https://www.chemotion-repository.net/inchikey/CXGDPEBXNOAMCA-UHFFFAOYSA-N/CHMO0000480
Version
Author	Christoph Zippel
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T05:45:21.262929
MetadataModified	2024-09-07T21:19:39.412067
MetadataPublished	2022-01-21

Field	Value
Measurement Technique	electron ionisation mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
SCHEMBL2030797	SureChEMBL
87326226	PubChem
The data in this table is sourced from UniChem at EBI.