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4H-Cyclopenta-1,3-dioxole-4-acetic acid, tetrahydro-6-(6-methoxy-9H-purin-9-yl)-2,2-dimethyl-, ethyl ester, [3aR-(3a.alpha.,4.alpha.,6.alpha.,6a.alpha.)]-

View entire compound with spectra: 1 MS (GC)

4H-Cyclopenta-1,3-dioxole-4-acetic acid, tetrahydro-6-(6-methoxy-9H-purin-9-yl)-2,2-dimethyl-, ethyl ester, [3aR-(3a.alpha.,4.alpha.,6.alpha.,6a.alpha.)]-
SpectraBase Compound ID DmdGvHJL4ev
InChI InChI=1S/C18H24N4O5/c1-5-25-12(23)7-10-6-11(15-14(10)26-18(2,3)27-15)22-9-21-13-16(22)19-8-20-17(13)24-4/h8-11,14-15H,5-7H2,1-4H3/t10-,11-,14-,15+/m1/s1
InChIKey QATSMSDUAIFFNJ-FKGLVLAHSA-N
Mol Weight 376.41 g/mol
Molecular Formula C18H24N4O5
Exact Mass 376.17467 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PQPubrsRbI
Name 4H-Cyclopenta-1,3-dioxole-4-acetic acid, tetrahydro-6-(6-methoxy-9H-purin-9-yl)-2,2-dimethyl-, ethyl ester, [3aR-(3a.alpha.,4.alpha.,6.alpha.,6a.alpha.)]-
CAS Registry Number 119833-75-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24N4O5
InChI InChI=1S/C18H24N4O5/c1-5-25-12(23)7-10-6-11(15-14(10)26-18(2,3)27-15)22-9-21-13-16(22)19-8-20-17(13)24-4/h8-11,14-15H,5-7H2,1-4H3/t10-,11-,14-,15+/m1/s1
InChIKey QATSMSDUAIFFNJ-FKGLVLAHSA-N
Molecular Weight 376.413 g/mol
SMILES c12[n](cnc2c(OC)ncn1)[C@]1([C@]2([C@@](OC(O2)(C)C)([H])[C@](C1)(CC(=O)OCC)[H])[H])[H]
SPLASH splash10-001i-0295000000-7852d9bd7080de88f8ea
Source of Spectrum KC-1988-2930-12
Synonyms (3aR,4R,6R,6aS)-ethyl 4,5,6,6a-tetrahydro-6-(6-methoxy-9H-purin-9-yl)-2,2-dimethyl-3ah-cyclopenta-1,3-dioxole-4-acetate Ethyl[(3aR,4R,6R,6aS)-6-(6-methoxy-9H-purin-9-yl)-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl]acetate
Wiley ID 1357553