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4,6,8-Trimethyl-5-(4-nitrophenyl)-2,3-dihydro-1,4-benzoxazepinium Iodide
SpectraBase Compound ID DWoMxb79HyE
InChI InChI=1S/C18H19N2O3.HI/c1-12-10-13(2)17-16(11-12)23-9-8-19(3)18(17)14-4-6-15(7-5-14)20(21)22;/h4-7,10-11H,8-9H2,1-3H3;1H/q+1;/p-1
InChIKey YPFDZABWXODKIK-UHFFFAOYSA-M
Mol Weight 438.27 g/mol
Molecular Formula C18H19IN2O3
Exact Mass 438.044037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOAaNxcNMME
Name 4,6,8-Trimethyl-5-(4-nitrophenyl)-2,3-dihydro-1,4-benzoxazepinium Iodide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19IN2O3
InChI InChI=1S/C18H19N2O3.HI/c1-12-10-13(2)17-16(11-12)23-9-8-19(3)18(17)14-4-6-15(7-5-14)20(21)22;/h4-7,10-11H,8-9H2,1-3H3;1H/q+1;/p-1
InChIKey YPFDZABWXODKIK-UHFFFAOYSA-M
Molecular Weight 438.265 g/mol
SMILES [I-].C1(=[N+](CCOc2c1c(cc(c2)C)C)C)c1ccc(N(=O)=O)cc1
SPLASH splash10-00ou-0940000000-f7c68a9517912aab7fc2
Source of Spectrum HC-49-336-16
Synonyms 4,6,8-trimethyl-5-(4-nitrophenyl)-2,3-dihydrobenzo[f][1,4]oxazepin-4-ium iodide
Wiley ID 1739652