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Benzene, 2-bromo-1-(3,3-diethoxypentyl)-3,5-bis(phenylmethoxy)-
SpectraBase Compound ID DQXqcSASOAe
InChI InChI=1S/C29H35BrO4/c1-4-29(33-5-2,34-6-3)18-17-25-19-26(31-21-23-13-9-7-10-14-23)20-27(28(25)30)32-22-24-15-11-8-12-16-24/h7-16,19-20H,4-6,17-18,21-22H2,1-3H3
InChIKey ZCPUFCNHHAGDSQ-UHFFFAOYSA-N
Mol Weight 527.5 g/mol
Molecular Formula C29H35BrO4
Exact Mass 526.171873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IuXeJ36NU7R
Name Benzene, 2-bromo-1-(3,3-diethoxypentyl)-3,5-bis(phenylmethoxy)-
CAS Registry Number 105705-42-8
Comments Less than 3 mono-isotopic peaks
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Formula C29H35BrO4
InChI InChI=1S/C29H35BrO4/c1-4-29(33-5-2,34-6-3)18-17-25-19-26(31-21-23-13-9-7-10-14-23)20-27(28(25)30)32-22-24-15-11-8-12-16-24/h7-16,19-20H,4-6,17-18,21-22H2,1-3H3
InChIKey ZCPUFCNHHAGDSQ-UHFFFAOYSA-N
Molecular Weight 527.499 g/mol
SMILES c1(c(c(CCC(OCC)(OCC)CC)cc(c1)OCc1ccccc1)Br)OCc1ccccc1
SPLASH splash10-0006-9000000000-02f485d6bcb8c6e5528c
Source of Spectrum B-39-795-14
Synonyms 2-bromo-1-(3,3-diethoxypentyl)-3,5-bis(phenylmethoxy)benzene 1,5-dibenzyloxy-2-bromo-3-(3,3-diethoxypentyl)benzene 2-bromanyl-1-(3,3-diethoxypentyl)-3,5-bis(phenylmethoxy)benzene
Wiley ID 1402830