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1,4-Ethano-1H-benzocycloheptene, 4,6,7,8-tetrahydro-
SpectraBase Compound ID AdmJWJZWtH9
InChI InChI=1S/C13H16/c1-2-4-12-10-6-8-11(9-7-10)13(12)5-3-1/h4-6,8,10-11H,1-3,7,9H2
InChIKey ACOCELUXYQJPLY-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C13H16
Exact Mass 172.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzDKLCao4lf
Name 1,4-Ethano-1H-benzocycloheptene, 4,6,7,8-tetrahydro-
CAS Registry Number 86661-59-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16
InChI InChI=1S/C13H16/c1-2-4-12-10-6-8-11(9-7-10)13(12)5-3-1/h4-6,8,10-11H,1-3,7,9H2
InChIKey ACOCELUXYQJPLY-UHFFFAOYSA-N
Molecular Weight 172.271 g/mol
SMILES C=12C(C3C=CC2CC3)=CCCCC1
SPLASH splash10-004l-0900000000-e5287734e2fbc755e930
Source of Spectrum K-116-2303-0
Synonyms Tricyclo[7.2.2.0(2,8)]trideca-2,7,10-triene
Wiley ID 1169508