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Adenine, N-[4-(benzyloxy)-3-[(benzyloxy)methyl]butyl]-
SpectraBase Compound ID D13vpNUxSy3
InChI InChI=1S/C24H27N5O2/c1-3-7-19(8-4-1)13-30-15-21(16-31-14-20-9-5-2-6-10-20)11-12-25-23-22-24(27-17-26-22)29-18-28-23/h1-10,17-18,21H,11-16H2,(H2,25,26,27,28,29)
InChIKey PSSYQTOOJXPMQJ-UHFFFAOYSA-N
Mol Weight 417.51 g/mol
Molecular Formula C24H27N5O2
Exact Mass 417.216475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vZm1GqFlQF
Name Adenine, N-[4-(benzyloxy)-3-[(benzyloxy)methyl]butyl]-
Alternate Name(s) N-(4-(Benzyloxy)-3-[(benzyloxy)methyl]butyl)-7H-purin-6-amine 6-4'-Benzyloxy-3'-benzyloxymethylbutylaminopurine N-[4-phenylmethoxy-3-(phenylmethoxymethyl)butyl]-7H-purin-6-amine [4-benzoxy-3-(benzoxymethyl)butyl]-(7H-purin-6-yl)amine
CAS Registry Number 33498-85-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27N5O2
InChI InChI=1S/C24H27N5O2/c1-3-7-19(8-4-1)13-30-15-21(16-31-14-20-9-5-2-6-10-20)11-12-25-23-22-24(27-17-26-22)29-18-28-23/h1-10,17-18,21H,11-16H2,(H2,25,26,27,28,29)
InChIKey PSSYQTOOJXPMQJ-UHFFFAOYSA-N
Molecular Weight 417.513 g/mol
SMILES N(CCC(COCc1ccccc1)COCc1ccccc1)c1c2c(nc[nH]2)ncn1
SPLASH splash10-0006-9710000000-94a2f96391f23a69e6a3
Source of Spectrum O5-0-833-0
Wiley ID 1376860