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exo/endo-7-chlorotetracyclo[4.1.0.0(2,4).0(3,5)]heptane
SpectraBase Compound ID 8dfKlQRj2PN
InChI InChI=1S/C7H7Cl/c8-7-5-3-1-2(3)4(1)6(5)7/h1-7H/t1-,2+,3-,4+,5?,6?,7?
InChIKey PBCVJFOGJAPOIG-UBBOCMNKSA-N
Mol Weight 126.59 g/mol
Molecular Formula C7H7Cl
Exact Mass 126.023628 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BnxiI3uc1Lc
Name exo/endo-7-chlorotetracyclo[4.1.0.0(2,4).0(3,5)]heptane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7Cl
InChI InChI=1S/C7H7Cl/c8-7-5-3-1-2(3)4(1)6(5)7/h1-7H/t1-,2+,3-,4+,5?,6?,7?
InChIKey PBCVJFOGJAPOIG-UBBOCMNKSA-N
Literature Reference DOI 10.1002/cber.19781110626
Molecular Weight 126.586 g/mol
SMILES [C@]12(C3C([C@@]4([C@]2([C@]14[H])[H])[H])C3Cl)[H]
SPLASH splash10-00kf-9000000000-70c728750aeffea6ce7c
Source of Spectrum K-111-2317-2f/2g
Synonyms 7-Chlorotetracyclo[4.1.0.0(2,4).0(3,5)]heptane
Wiley ID 1794269