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Phosphonic acid, 1H-2,3-benzodiazepin-1-yl-, diethyl ester
SpectraBase Compound ID 3iT8nMQNA6Z
InChI InChI=1S/C13H17N2O3P/c1-3-17-19(16,18-4-2)13-12-8-6-5-7-11(12)9-10-14-15-13/h5-10,13H,3-4H2,1-2H3
InChIKey DSHAMMHSFOUMOA-UHFFFAOYSA-N
Mol Weight 280.26 g/mol
Molecular Formula C13H17N2O3P
Exact Mass 280.097679 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfeuhzbbI4P
Name Phosphonic acid, 1H-2,3-benzodiazepin-1-yl-, diethyl ester
CAS Registry Number 93031-98-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N2O3P
InChI InChI=1S/C13H17N2O3P/c1-3-17-19(16,18-4-2)13-12-8-6-5-7-11(12)9-10-14-15-13/h5-10,13H,3-4H2,1-2H3
InChIKey DSHAMMHSFOUMOA-UHFFFAOYSA-N
Molecular Weight 280.264 g/mol
SMILES C1(P(=O)(OCC)OCC)N=NC=Cc2c1cccc2
SPLASH splash10-014j-0920000000-e15e22ea5bddedd2febd
Source of Spectrum AH-115-644-0
Synonyms 1H-2,3-benzodiazepine, phosphonic acid deriv. Diethyl 1H-2,3-benzodiazepin-1-ylphosphonate Diethylester of 1-H-2,3-benzo-diazepin-1-yl-phosphoric acid
Wiley ID 1283541