Pharmaceutical Quality - Chemistry, Manufacturing and Controls (PQ-CMC) Submissions to FDA
1.1.6 - Reconciliation + Stage 2 Connectathon
Pharmaceutical Quality - Chemistry, Manufacturing and Controls (PQ-CMC) Submissions to FDA
1.1.6 - Reconciliation + Stage 2 Connectathon
Pharmaceutical Quality - Chemistry, Manufacturing and Controls (PQ-CMC) Submissions to FDA, published by HL7 International / Biomedical Research and Regulation. This guide is not an authorized publication; it is the continuous build for version 1.1.6 built by the FHIR (HL7® FHIR® Standard) CI Build. This version is based on the current content of https://github.com/HL7/FHIR-us-pq-cmc-fda/ and changes regularly. See the Directory of published versions
Generated Narrative: SubstanceDefinition ac7ac2da-df69-4ed9-b399-4dc40a71b332
identifier: PhenylAcetone
classification: Process Related/Process
characterization
technique: IR Spectroscopy
Files
ContentType Data Title application/x-jcamp-dx (base64 data - 5,896 base64 chars) PhenylAcetone-IR.jdx
characterization
technique: Proton NMR and Carbon NMR
description:
A phenylacetone sample was analyzed using HNMR and CNMR spectroscopy. The assignments of the protons and carbons are detailed in the tables below.
Table 1: HNMR Assignments for Phenylacetone
Hydrogen No. Delta (ppm) Multiplicity No. of Protons Coupling (Hz) H1 7.251 tt 1 7.71, 1.53 H2,H3 7.305 tdd 2 7.74 1.82 0.55 H4,H5 7.11 dddd 2 7.77 1.53 1.20 0.55 H6,H7 3.589 s 2 -- H8,H9,H10 2.145 s 3 -- Table 2 : CNMR Assignments for Phenylacetone
Carbon No. Delta (ppm) C1 128.10 C2,C6 128.60 C3,C5 128.40 C4 133.70 C7 50.24 C8 205.55 C9 29.9 Files
ContentType Data Title application/x-jcamp-dx (base64 data - 16,200 base64 chars) PhenylAecetone-HNMR.jdx image/svg+xml (base64 data - 199,128 base64 chars) PhenylAcetone-HNMR.svg application/x-jcamp-dx (base64 data - 1,760 base64 chars) PhenylAcetone-CNMR.jdx image/png (base64 data - 69,124 base64 chars) PhenylAcetone-CNMR.png
structure
technique: HNMR, IR Spectroscopy
representation
type: Structure
representation: InChI=1S/C9H10O/c1-8(10)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3
representation
type: Structure
representation: CC(=O)CC1=CC=CC=C1
representation
type: Structure
| Code |
| O7IZH10V9Y |
| Name | Type | Preferred |
| PHENYL ACETONE | GSRS Preferred Term | true |
IG © 2021+ HL7 International / Biomedical Research and Regulation. Package hl7.fhir.us.pq-cmc-fda#1.1.6 based on FHIR 5.0.0. Generated 2024-09-22
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