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2H,7H-10,4a-(Nitrilomethano)benzocyclooctene, 1,3,4,8,9,10-hexahydro-8,8-dimethyl-, trans-
SpectraBase Compound ID Fp5UgfnBcGU
InChI InChI=1S/C15H23N/c1-14(2)7-5-9-15-8-4-3-6-13(15)12(10-14)11-16-15/h4,6,8,12,16H,3,5,7,9-11H2,1-2H3/t12-,15+/m0/s1
InChIKey MSBOXJSEQKVFLG-SWLSCSKDSA-N
Mol Weight 217.36 g/mol
Molecular Formula C15H23N
Exact Mass 217.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ISch740shvF
Name 2H,7H-10,4a-(Nitrilomethano)benzocyclooctene, 1,3,4,8,9,10-hexahydro-8,8-dimethyl-, trans-
Alternate Name(s) (1S,7R)-9,9-dimethyl-13-azatricyclo[5.5.2.0(1,6)]tetradeca-2,5-diene 5,5-Dimethyl-14-aza-tricyclo[4.6.2(1,7).0.]tetradecan-2,7(14)-diene
CAS Registry Number 108392-89-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H23N
InChI InChI=1S/C15H23N/c1-14(2)7-5-9-15-8-4-3-6-13(15)12(10-14)11-16-15/h4,6,8,12,16H,3,5,7,9-11H2,1-2H3/t12-,15+/m0/s1
InChIKey MSBOXJSEQKVFLG-SWLSCSKDSA-N
Molecular Weight 217.356 g/mol
SMILES N1C[C@]2(C=3[C@]1(CCCC(C2)(C)C)C=CCC3)[H]
SPLASH splash10-001i-9020000000-cac80df33e2d910c820b
Source of Spectrum J-52-2353-42
Wiley ID 1216864