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7-Acetyl-1-(phenylcarbamoyl)-4,4,6,8-tetramethyl-5-nitro-1,4-dihydro-3H-2,1-benzoxazine
SpectraBase Compound ID BnsBEEcFUAb
InChI InChI=1S/C21H23N3O5/c1-12-16(14(3)25)13(2)19(24(27)28)17-18(12)23(29-11-21(17,4)5)20(26)22-15-9-7-6-8-10-15/h6-10H,11H2,1-5H3,(H,22,26)
InChIKey HAYBOELHLRWZQZ-UHFFFAOYSA-N
Mol Weight 397.43 g/mol
Molecular Formula C21H23N3O5
Exact Mass 397.163771 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AucPOTzaN26
Name 7-Acetyl-1-(phenylcarbamoyl)-4,4,6,8-tetramethyl-5-nitro-1,4-dihydro-3H-2,1-benzoxazine
Alternate Name(s) 7-Acetyl-4,4,6,8-tetramethyl-5-nitro-N-phenyl-3,4-dihydro-1H-benzo[c][1,2]oxazine-1-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3O5
InChI InChI=1S/C21H23N3O5/c1-12-16(14(3)25)13(2)19(24(27)28)17-18(12)23(29-11-21(17,4)5)20(26)22-15-9-7-6-8-10-15/h6-10H,11H2,1-5H3,(H,22,26)
InChIKey HAYBOELHLRWZQZ-UHFFFAOYSA-N
Molecular Weight 397.431 g/mol
SMILES N(C(N1c2c(c(c(c(c2C)C(=O)C)C)[N+]([O-])=O)C(CO1)(C)C)=O)c1ccccc1
SPLASH splash10-004i-0090000000-15792ea128c020658380
Source of Spectrum K-108-3493-15a
Wiley ID 1793833