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Bromazepam-M (HO-) HYME

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Bromazepam-M (HO-) HYME
SpectraBase Compound ID I4MlyALdOZH
InChI InChI=1S/C13H11BrN2O2/c1-15-11-7-12(17)9(14)6-8(11)13(18)10-4-2-3-5-16-10/h2-7,15,17H,1H3
InChIKey XEQHUELEZXJQKN-UHFFFAOYSA-N
Mol Weight 307.15 g/mol
Molecular Formula C13H11BrN2O2
Exact Mass 306.000391 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7hfJn3X193S
Name Bromazepam-m (ho-) hyme P941
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 306.000390600 u
Formula C13H11BrN2O2
InChI InChI=1S/C13H11BrN2O2/c1-15-11-7-12(17)9(14)6-8(11)13(18)10-4-2-3-5-16-10/h2-7,15,17H,1H3
InChIKey XEQHUELEZXJQKN-UHFFFAOYSA-N
Molecular Weight 307.147 g/mol
SMILES C=1(C=C(C(C(=O)C=2N=CC=CC2)=CC1Br)NC)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.917115