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5,9-Etheno-5H-benzocycloheptene, 6,7,8,9-tetrahydro-
SpectraBase Compound ID H1SUX7VZqgN
InChI InChI=1S/C13H14/c1-2-7-13-11-5-3-4-10(8-9-11)12(13)6-1/h1-2,6-11H,3-5H2
InChIKey WJHBSGWBIGPUBG-UHFFFAOYSA-N
Mol Weight 170.25 g/mol
Molecular Formula C13H14
Exact Mass 170.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID fYel82Knj4
Name 5,9-Etheno-5H-benzocycloheptene, 6,7,8,9-tetrahydro-
Alternate Name(s) 6,7-Benzobicyclo[3.2.2]6,8-nonadiene tricyclo[6.3.2.0(2,7)]trideca-2,4,6,12-tetraene
CAS Registry Number 34598-76-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14
InChI InChI=1S/C13H14/c1-2-7-13-11-5-3-4-10(8-9-11)12(13)6-1/h1-2,6-11H,3-5H2
InChIKey WJHBSGWBIGPUBG-UHFFFAOYSA-N
Molecular Weight 170.255 g/mol
SMILES c12c(C3CCCC1C=C3)cccc2
SPLASH splash10-0006-0900000000-83f64973782dc7486a0c
Source of Spectrum F-46-3832-15
Wiley ID 1167670