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(4aR)-2,4a,5,8-Tetrahydro-3,5,5,9-tetramethyl-1H-benzocycloheptene
SpectraBase Compound ID DeMkdi1AHTy
InChI InChI=1S/C15H22/c1-11-7-8-13-12(2)6-5-9-15(3,4)14(13)10-11/h5,9-10,14H,6-8H2,1-4H3/t14-/m0/s1
InChIKey RCLAKHWEQLCGKJ-AWEZNQCLSA-N
Mol Weight 202.34 g/mol
Molecular Formula C15H22
Exact Mass 202.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EyQccCwmvKt
Name (4aR)-2,4a,5,8-Tetrahydro-3,5,5,9-tetramethyl-1H-benzocycloheptene
Alternate Name(s) (R)-3,5,5,9-tetramethyl-2,4a,5,8-tetrahydro-1H-benzo[7]annulene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22
InChI InChI=1S/C15H22/c1-11-7-8-13-12(2)6-5-9-15(3,4)14(13)10-11/h5,9-10,14H,6-8H2,1-4H3/t14-/m0/s1
InChIKey RCLAKHWEQLCGKJ-AWEZNQCLSA-N
Literature Reference DOI 10.1002/hlca.200690025
Molecular Weight 202.341 g/mol
SMILES CC1(C)[C@]2([H])C(=C(CC=C1)C)CCC(C)=C2
SPLASH splash10-0006-9300000000-a0182a9c4c4986caefb5
Source of Spectrum H-89-238-20
Wiley ID 1785660