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3-tert-Butyl-5-chloro-8,9-dihydro-7H-benzocycloheptene-6-carbaldehyde
SpectraBase Compound ID JP6mvNoeaWz
InChI InChI=1S/C16H19ClO/c1-16(2,3)13-8-7-11-5-4-6-12(10-18)15(17)14(11)9-13/h7-10H,4-6H2,1-3H3
InChIKey ILGBSACIZYFNPB-UHFFFAOYSA-N
Mol Weight 262.78 g/mol
Molecular Formula C16H19ClO
Exact Mass 262.112443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5AjDMDHA0Z0
Name 3-tert-Butyl-5-chloro-8,9-dihydro-7H-benzocycloheptene-6-carbaldehyde
Alternate Name(s) 2-(t-Butyl)-9-chloro-6,7-dihydro-5H-benzocycloheptene-8-carboxylate 2-tert-Butyl-9-chloro-6,7-dihydro-5H-benzo[a]cycloheptene-8-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19ClO
InChI InChI=1S/C16H19ClO/c1-16(2,3)13-8-7-11-5-4-6-12(10-18)15(17)14(11)9-13/h7-10H,4-6H2,1-3H3
InChIKey ILGBSACIZYFNPB-UHFFFAOYSA-N
Molecular Weight 262.780 g/mol
SMILES C=1(c2cc(C(C)(C)C)ccc2CCCC1C=O)Cl
SPLASH splash10-0002-0090000000-10c1d6367767c21a32d1
Source of Spectrum H-87-1788-51
Wiley ID 1563960