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n-hexyl benzylsuccinate

View entire compound with spectra: 1 MS (GC)

n-hexyl benzylsuccinate
SpectraBase Compound ID DkI1xZhvjj3
InChI InChI=1S/C17H24O4/c1-2-3-4-8-11-21-17(20)15(13-16(18)19)12-14-9-6-5-7-10-14/h5-7,9-10,15H,2-4,8,11-13H2,1H3,(H,18,19)
InChIKey XHSZZZCFRFWYKQ-UHFFFAOYSA-N
Mol Weight 292.37 g/mol
Molecular Formula C17H24O4
Exact Mass 292.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZK6mz1kZRX
Name n-hexyl benzylsuccinate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O4
InChI InChI=1S/C17H24O4/c1-2-3-4-8-11-21-17(20)15(13-16(18)19)12-14-9-6-5-7-10-14/h5-7,9-10,15H,2-4,8,11-13H2,1H3,(H,18,19)
InChIKey XHSZZZCFRFWYKQ-UHFFFAOYSA-N
Molecular Weight 292.375 g/mol
SMILES OC(CC(C(=O)OCCCCCC)Cc1ccccc1)=O
SPLASH splash10-052f-9300000000-6691b33f70d48754d117
Source of Spectrum JC-446-106-0
Synonyms 3-Benzyl-4-(hexyloxy)-4-oxobutanoic acid
Wiley ID 1295581