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Morpholine, 3-(chloromethyl)-4-(phenylmethyl)-
SpectraBase Compound ID AGJpC2XQ3tg
InChI InChI=1S/C12H16ClNO/c13-8-12-10-15-7-6-14(12)9-11-4-2-1-3-5-11/h1-5,12H,6-10H2
InChIKey MSRCVCNYPADFER-UHFFFAOYSA-N
Mol Weight 225.72 g/mol
Molecular Formula C12H16ClNO
Exact Mass 225.092042 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EHr1dG4ZmcU
Name Morpholine, 3-(chloromethyl)-4-(phenylmethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 225.092041838 u
Formula C12H16ClNO
InChI InChI=1S/C12H16ClNO/c13-8-12-10-15-7-6-14(12)9-11-4-2-1-3-5-11/h1-5,12H,6-10H2
InChIKey MSRCVCNYPADFER-UHFFFAOYSA-N
Molecular Weight 225.719 g/mol
SMILES C1N(C(CCl)COC1)CC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.921557