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megastigma-3,7(Z),9-triene
SpectraBase Compound ID AV9q5xMDHJN
InChI InChI=1S/C13H20/c1-5-6-9-12-11(2)8-7-10-13(12,3)4/h5-9,11-12H,1,10H2,2-4H3/b9-6-
InChIKey PGQWCXGMUUWKJO-TWGQIWQCSA-N
Mol Weight 176.3 g/mol
Molecular Formula C13H20
Exact Mass 176.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DVVepG90XS6
Name megastigma-3,7(Z),9-triene
Alternate Name(s) 4-[(1Z)-1,3-butadienyl]-3,5,5-trimethyl-1-cyclohexene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20
InChI InChI=1S/C13H20/c1-5-6-9-12-11(2)8-7-10-13(12,3)4/h5-9,11-12H,1,10H2,2-4H3/b9-6-
InChIKey PGQWCXGMUUWKJO-TWGQIWQCSA-N
Molecular Weight 176.303 g/mol
SMILES C1(C(CC=CC1C)(C)C)\C=C/C=C
SPLASH splash10-052f-9200000000-2952b5679d334e46ca6e
Source of Spectrum XW-594-0-0
Wiley ID 1172875