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4,6,8-Trimethyl-5-phenyl-2,3-dihydro-1,4-benzoxazepinium Iodide

View entire compound with spectra: 1 MS (GC)

4,6,8-Trimethyl-5-phenyl-2,3-dihydro-1,4-benzoxazepinium Iodide
SpectraBase Compound ID 8HbzICaO7Tm
InChI InChI=1S/C18H20NO.HI/c1-13-11-14(2)17-16(12-13)20-10-9-19(3)18(17)15-7-5-4-6-8-15;/h4-8,11-12H,9-10H2,1-3H3;1H/q+1;/p-1
InChIKey IVQUOAYNMNNXPG-UHFFFAOYSA-M
Mol Weight 393.27 g/mol
Molecular Formula C18H20INO
Exact Mass 393.058959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GyP0ihUbCrf
Name 4,6,8-Trimethyl-5-phenyl-2,3-dihydro-1,4-benzoxazepinium Iodide
Alternate Name(s) 4,6,8-trimethyl-5-phenyl-2,3-dihydrobenzo[f][1,4]oxazepin-4-ium iodide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20INO
InChI InChI=1S/C18H20NO.HI/c1-13-11-14(2)17-16(12-13)20-10-9-19(3)18(17)15-7-5-4-6-8-15;/h4-8,11-12H,9-10H2,1-3H3;1H/q+1;/p-1
InChIKey IVQUOAYNMNNXPG-UHFFFAOYSA-M
Molecular Weight 393.268 g/mol
SMILES [I-].C1(=[N+](CCOc2c1c(cc(c2)C)C)C)c1ccccc1
SPLASH splash10-002u-9100000000-cc2485ca1d7b1cae51e2
Source of Spectrum HC-49-336-15
Wiley ID 1739653