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2',6'-ditert-butyl-6-chloro-2-phenylspiro[2,4-dihydro-1,4-benzoxazine-3,4'-cyclohexa-2,5-diene]-1'-one
SpectraBase Compound ID AP6myxogBwl
InChI InChI=1S/C27H30ClNO2/c1-25(2,3)19-15-27(16-20(23(19)30)26(4,5)6)24(17-10-8-7-9-11-17)31-22-13-12-18(28)14-21(22)29-27/h7-16,24,29H,1-6H3
InChIKey ACYKWABLGUABAR-UHFFFAOYSA-N
Mol Weight 436.0 g/mol
Molecular Formula C27H30ClNO2
Exact Mass 435.196507 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5TW4SE1b4lW
Name 2',6'-ditert-butyl-6-chloro-2-phenylspiro[2,4-dihydro-1,4-benzoxazine-3,4'-cyclohexa-2,5-diene]-1'-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 435.196506908 u
Formula C27H30ClNO2
InChI InChI=1S/C27H30ClNO2/c1-25(2,3)19-15-27(16-20(23(19)30)26(4,5)6)24(17-10-8-7-9-11-17)31-22-13-12-18(28)14-21(22)29-27/h7-16,24,29H,1-6H3
InChIKey ACYKWABLGUABAR-UHFFFAOYSA-N
Molecular Weight 435.995 g/mol
NMR Offset 16.8468
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_639
Solvent DMSO-d6
Source Vendor ID: ZI/8071232; Lab Info: LEZ; Lab Number: LES-rost537
Temperature 23.85 °C