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anti-10-[3-chlor-2-(chlormethyl)propyl]-5,6,8,9-tetrahydro-5,9-methano-7h-benzocyclohepten-7-on
SpectraBase Compound ID ECbC6uyUfAG
InChI InChI=1S/C16H18Cl2O/c17-8-10(9-18)5-14-15-6-11(19)7-16(14)13-4-2-1-3-12(13)15/h1-4,10,14-16H,5-9H2
InChIKey NLLWHODMVFAONE-UHFFFAOYSA-N
Mol Weight 297.23 g/mol
Molecular Formula C16H18Cl2O
Exact Mass 296.073471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 18BH5Lb5FcA
Name anti-10-[3-chlor-2-(chlormethyl)propyl]-5,6,8,9-tetrahydro-5,9-methano-7h-benzocyclohepten-7-on
Alternate Name(s) 12-[3-chloro-2-(chloromethyl)propyl]tricyclo[6.3.1.0(2,7)]dodeca-2,4,6-trien-10-one
CAS Registry Number 101542-84-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18Cl2O
InChI InChI=1S/C16H18Cl2O/c17-8-10(9-18)5-14-15-6-11(19)7-16(14)13-4-2-1-3-12(13)15/h1-4,10,14-16H,5-9H2
InChIKey NLLWHODMVFAONE-UHFFFAOYSA-N
Molecular Weight 297.225 g/mol
SMILES C1(C2c3ccccc3C1CC(=O)C2)CC(CCl)CCl
SPLASH splash10-002o-0940000000-28a350d3dfae35500f8b
Source of Spectrum K-119-1975-18
Wiley ID 1298992