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mCPP-M (deethylene-) 2AC @

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

mCPP-M (deethylene-) 2AC @
SpectraBase Compound ID 7sDme5ZtKWD
InChI InChI=1S/C12H15ClN2O2/c1-9(16)14-6-7-15(10(2)17)12-5-3-4-11(13)8-12/h3-5,8H,6-7H2,1-2H3,(H,14,16)
InChIKey RLWRZKUMAMYZAG-UHFFFAOYSA-N
Mol Weight 254.72 g/mol
Molecular Formula C12H15ClN2O2
Exact Mass 254.082205 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KPLyjPlbRNX
Name Mcpp-m (deethylene-) 2ac @P627
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.082205429 u
Formula C12H15ClN2O2
InChI InChI=1S/C12H15ClN2O2/c1-9(16)14-6-7-15(10(2)17)12-5-3-4-11(13)8-12/h3-5,8H,6-7H2,1-2H3,(H,14,16)
InChIKey RLWRZKUMAMYZAG-UHFFFAOYSA-N
Molecular Weight 254.717 g/mol
SMILES C=1C=C(C=C(C1)Cl)N(C(C)=O)CCNC(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.826496