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1-{(S(a)-2'-[2-(N,N-diisopropylcarbamoyloxy)-1,1'-binaphthyl]oxy}-6-iodohexane
SpectraBase Compound ID DytBOxJtqcl
InChI InChI=1S/C33H38INO3/c1-23(2)35(24(3)4)33(36)38-30-20-18-26-14-8-10-16-28(26)32(30)31-27-15-9-7-13-25(27)17-19-29(31)37-22-12-6-5-11-21-34/h7-10,13-20,23-24H,5-6,11-12,21-22H2,1-4H3
InChIKey MOCZGPAEBUURFZ-UHFFFAOYSA-N
Mol Weight 623.6 g/mol
Molecular Formula C33H38INO3
Exact Mass 623.189639 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K2Zoghv1jqA
Name 1-{(S(a)-2'-[2-(N,N-diisopropylcarbamoyloxy)-1,1'-binaphthyl]oxy}-6-iodohexane
Alternate Name(s) N,N-di(propan-2-yl)carbamic acid [1-[2-(6-iodohexoxy)-1-naphthalenyl]-2-naphthalenyl] ester [1-[2-(6-iodohexoxy)naphthalen-1-yl]naphthalen-2-yl] N,N-di(propan-2-yl)carbamate [1-[2-(6-iodohexoxy)-1-naphthyl]-2-naphthyl] N,N-diisopropylcarbamate [1-[2-(6-iodanylhexoxy)naphthalen-1-yl]naphthalen-2-yl] N,N-di(propan-2-yl)carbamate
Comments Less than 3 mono-isotopic peaks
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Formula C33H38INO3
InChI InChI=1S/C33H38INO3/c1-23(2)35(24(3)4)33(36)38-30-20-18-26-14-8-10-16-28(26)32(30)31-27-15-9-7-13-25(27)17-19-29(31)37-22-12-6-5-11-21-34/h7-10,13-20,23-24H,5-6,11-12,21-22H2,1-4H3
InChIKey MOCZGPAEBUURFZ-UHFFFAOYSA-N
Molecular Weight 623.575 g/mol
SMILES C(Oc1c(-c2c3c(cccc3)ccc2OCCCCCCI)c2ccccc2cc1)(N(C(C)C)C(C)C)=O
SPLASH splash10-0002-0000900000-56594b73314e2d1da7b7
Source of Spectrum KC-0-4425-14
Wiley ID 832105