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2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 4-nitro-
SpectraBase Compound ID ILmAmhSGOyv
InChI InChI=1S/C4H6NO5P/c6-5(7)4-1-8-11(9-2-4)10-3-4/h1-3H2
InChIKey UTQLCFUCRQSESN-UHFFFAOYSA-N
Mol Weight 179.07 g/mol
Molecular Formula C4H6NO5P
Exact Mass 178.998359 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESOQBjLbstT
Name 2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 4-nitro-
CAS Registry Number 3048-73-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H6NO5P
InChI InChI=1S/C4H6NO5P/c6-5(7)4-1-8-11(9-2-4)10-3-4/h1-3H2
InChIKey UTQLCFUCRQSESN-UHFFFAOYSA-N
Molecular Weight 179.068 g/mol
SMILES C12(N(=O)=O)COP(OC2)OC1
SPLASH splash10-000m-9100000000-17f10fdfae5e40ca89da
Source of Spectrum AD-0-1496-0
Synonyms 4-Nitro-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane 1,3-Propanediol, 2-(hydroxymethyl)-2-nitro-, cyclic phosphite 4-Nitro-2,6,7-trioxa-1-phosphabicyclo(2.2.2)octane
Wiley ID 1174973