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2,3-dihydro-7,8-dimethyl-4-(p-fluorophenyl)-1H-1,5-benzodiazepine

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

2,3-dihydro-7,8-dimethyl-4-(p-fluorophenyl)-1H-1,5-benzodiazepine
SpectraBase Compound ID D5ziLP6Fhfp
InChI InChI=1S/C17H17FN2/c1-11-9-16-17(10-12(11)2)20-15(7-8-19-16)13-3-5-14(18)6-4-13/h3-6,9-10,19H,7-8H2,1-2H3
InChIKey HYWSSYWPWYIKGC-UHFFFAOYSA-N
Mol Weight 268.34 g/mol
Molecular Formula C17H17FN2
Exact Mass 268.137577 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 4LAvHiG2AFf
Name 2,3-Dihydro-7,8-dimethyl-4-(p-fluorophenyl)-1H-1,5-benzodiazepine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.137576718 u
Formula C17H17FN2
InChI InChI=1S/C17H17FN2/c1-11-9-16-17(10-12(11)2)20-15(7-8-19-16)13-3-5-14(18)6-4-13/h3-6,9-10,19H,7-8H2,1-2H3
InChIKey HYWSSYWPWYIKGC-UHFFFAOYSA-N
Molecular Weight 268.335 g/mol
SMILES N1C=2C=C(C(=CC2N=C(CC1)C=1C=CC(=CC1)F)C)C
Spectrum/Structure Validation Score (Raman) 0.873088