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HTHCCJNCERZLBA-UHFFFAOYSA-N
SpectraBase Compound ID KHatokT6mqh
InChI InChI=1S/C19H19NO3/c1-12(2)18(21)20-11-14-10-13(3)8-9-17(14)23-19(22)15-6-4-5-7-16(15)20/h4-10,12H,11H2,1-3H3
InChIKey HTHCCJNCERZLBA-UHFFFAOYSA-N
Mol Weight 309.37 g/mol
Molecular Formula C19H19NO3
Exact Mass 309.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Sg7x0oH1Ds
Name 11-isobutyryl-2-methyl-12H-benzo[c][1,5]benzoxazocin-6-one
Alternate Name(s) 2-Methyl-11-(2-methyl-1-oxopropyl)-12H-benzo[c][1,5]benzoxazocin-6-one 2-Methyl-11-(2-methylpropanoyl)-12H-benzo[c][1,5]benzoxazocin-6-one
CAS Registry Number 126839-87-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19NO3
InChI InChI=1S/C19H19NO3/c1-12(2)18(21)20-11-14-10-13(3)8-9-17(14)23-19(22)15-6-4-5-7-16(15)20/h4-10,12H,11H2,1-3H3
InChIKey HTHCCJNCERZLBA-UHFFFAOYSA-N
Molecular Weight 309.365 g/mol
SMILES c12N(Cc3c(OC(c2cccc1)=O)ccc(c3)C)C(=O)C(C)C
SPLASH splash10-014i-4932000000-2e7c4624616680a452a9
Source of Spectrum Y-26-1386-11
Wiley ID 1310777