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Diels-Alder Adduct-19

View entire compound with spectra: 1 MS (GC)

Diels-Alder Adduct-19
SpectraBase Compound ID JwxZSU87hf9
InChI InChI=1S/C16H16/c1-2-9-6-7-13-14-10-4-5-11(8-10)15(14)16(13)12(9)3-1/h4-7,10-11,14-15H,1-3,8H2/t10-,11+,14+,15+/m1/s1
InChIKey LPPLIXQIHCSEDQ-PKIAMQTDSA-N
Mol Weight 208.3 g/mol
Molecular Formula C16H16
Exact Mass 208.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A8Hcz4vNQ1V
Name Diels-Alder Adduct-19
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16
InChI InChI=1S/C16H16/c1-2-9-6-7-13-14-10-4-5-11(8-10)15(14)16(13)12(9)3-1/h4-7,10-11,14-15H,1-3,8H2/t10-,11+,14+,15+/m1/s1
InChIKey LPPLIXQIHCSEDQ-PKIAMQTDSA-N
Molecular Weight 208.304 g/mol
SMILES c12[C@]3([C@]4(C=C[C@@]([C@]3(c2ccc2c1CCC2)[H])(C4)[H])[H])[H]
SPLASH splash10-0a4i-1950000000-435112af90b99369b58e
Source of Spectrum C-118-6866-19
Wiley ID 1698559