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8,8-Dimethyl-exo-2-(4-nitrobenzoyloxy)-2-azabicyclo[3.2.1]oct-6-ene
SpectraBase Compound ID 2LdcFl4yUzX
InChI InChI=1S/C16H18N2O4/c1-16(2)12-5-8-14(16)17(10-9-12)22-15(19)11-3-6-13(7-4-11)18(20)21/h3-8,12,14H,9-10H2,1-2H3/t12-,14-/m1/s1
InChIKey INUMDNWZPRYFTL-TZMCWYRMSA-N
Mol Weight 302.33 g/mol
Molecular Formula C16H18N2O4
Exact Mass 302.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KXKAGUKlVcn
Name 8,8-Dimethyl-exo-2-(4-nitrobenzoyloxy)-2-azabicyclo[3.2.1]oct-6-ene
CAS Registry Number 105731-52-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2O4
InChI InChI=1S/C16H18N2O4/c1-16(2)12-5-8-14(16)17(10-9-12)22-15(19)11-3-6-13(7-4-11)18(20)21/h3-8,12,14H,9-10H2,1-2H3/t12-,14-/m1/s1
InChIKey INUMDNWZPRYFTL-TZMCWYRMSA-N
Molecular Weight 302.330 g/mol
SMILES [C@]12(N(CC[C@](C2(C)C)(C=C1)[H])OC(c1ccc(N(=O)=O)cc1)=O)[H]
SPLASH splash10-0udl-6921000000-491d1510379714bb33d0
Source of Spectrum K-120-1778-19
Synonyms 8,8-Dimethyl-2-[(4-nitrobenzoyl)oxy]-2-azabicyclo[3.2.1]oct-6-ene
Wiley ID 1304563