(S)-2,2,2-trichloroethyl 1-(benzo[d][1,3]dioxol-5-yl)propan-2-yl(methyl)carbamate

SpectraBase Compound ID	D7xgz6O8OwV
InChI	InChI=1S/C14H16Cl3NO4/c1-9(18(2)13(19)20-7-14(15,16)17)5-10-3-4-11-12(6-10)22-8-21-11/h3-4,6,9H,5,7-8H2,1-2H3/t9-/m0/s1
InChIKey	RUEIKWWNAPTTRU-VIFPVBQESA-N Google Search
Mol Weight	368.64 g/mol
Molecular Formula	C14H16Cl3NO4
Exact Mass	367.014491 g/mol

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SpectraBase Spectrum ID	723OTJ3mbO7
Name	(S)-2,2,2-Trichloroethyl 1-(benzo[D][1,3]dioxol-5-yl)propan-2-yl(methyl)carbamate
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	367.014491095 u
Formula	C14H16Cl3NO4
InChI	InChI=1S/C14H16Cl3NO4/c1-9(18(2)13(19)20-7-14(15,16)17)5-10-3-4-11-12(6-10)22-8-21-11/h3-4,6,9H,5,7-8H2,1-2H3/t9-/m0/s1
InChIKey	RUEIKWWNAPTTRU-VIFPVBQESA-N
Molecular Weight	368.644 g/mol
SMILES	C12=CC(=CC=C2OCO1)C[C@@](N(C(OCC(Cl)(Cl)Cl)=O)C)(C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR)	0.914405