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4-Azatricyclo[4.3.1.1(3,8)]undecane, 4-(3-chloro-4-methylbenzoyl)-
SpectraBase Compound ID AAd1MJeIhQ2
InChI InChI=1S/C18H22ClNO/c1-11-2-3-15(9-17(11)19)18(21)20-10-14-5-12-4-13(6-14)8-16(20)7-12/h2-3,9,12-14,16H,4-8,10H2,1H3/t12-,13+,14-,16+
InChIKey VWGIEFJCEYWSSK-UWOLEIRVSA-N
Mol Weight 303.83 g/mol
Molecular Formula C18H22ClNO
Exact Mass 303.138992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 85Nax3VxSOp
Name 4-Azatricyclo[4.3.1.1(3,8)]undecane, 4-(3-chloro-4-methylbenzoyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22ClNO
InChI InChI=1S/C18H22ClNO/c1-11-2-3-15(9-17(11)19)18(21)20-10-14-5-12-4-13(6-14)8-16(20)7-12/h2-3,9,12-14,16H,4-8,10H2,1H3/t12-,13+,14-,16+
InChIKey VWGIEFJCEYWSSK-UWOLEIRVSA-N
Molecular Weight 303.833 g/mol
SMILES Cc1ccc(C(N2[C@]3(C[C@@]4(C[C@@](C2)(C[C@](C3)(C4)[H])[H])[H])[H])=O)cc1Cl
SPLASH splash10-0udi-1829000000-cab2728900716f2c1cf2
Source of Spectrum IY-1-4448-4
Wiley ID 1652467