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2-(4-methoxyphenyl)-4-(trifluoromethyl)-3H-1,5-benzodiazepine

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2-(4-methoxyphenyl)-4-(trifluoromethyl)-3H-1,5-benzodiazepine
SpectraBase Compound ID 3ckynwNIMFo
InChI InChI=1S/C17H13F3N2O/c1-23-12-8-6-11(7-9-12)15-10-16(17(18,19)20)22-14-5-3-2-4-13(14)21-15/h2-9H,10H2,1H3
InChIKey QDVVEVBKWVCABU-UHFFFAOYSA-N
Mol Weight 318.3 g/mol
Molecular Formula C17H13F3N2O
Exact Mass 318.097998 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Htq9ldxLzD
Name 2-(4-methoxyphenyl)-4-(trifluoromethyl)-3H-1,5-benzodiazepine
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C17H13F3N2O/c1-23-12-8-6-11(7-9-12)15-10-16(17(18,19)20)22-14-5-3-2-4-13(14)21-15/h2-9H,10H2,1H3
InChIKey QDVVEVBKWVCABU-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_11461
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 801927; Labnumber: REA14-1059; VK_ID: VK-011466
Synonyms methyl 4-[4-(trifluoromethyl)-3H-1,5-benzodiazepin-2-yl]phenyl ether
Temperature 315 °C