(3'RS,5'SR,8'RS)-9-(8'-ALLYLOXY-2'-PHENYL-7'-OXABICYCLO-[3.3.0]-OCT-1'-ENE-3'-YL)-9H-6-CHLOROPURINE

SpectraBase Compound ID	B85BoSplY1a
InChI	InChI=1S/C21H19ClN4O2/c1-2-8-27-21-17-14(10-28-21)9-15(16(17)13-6-4-3-5-7-13)26-12-25-18-19(22)23-11-24-20(18)26/h2-7,11-12,14-15,21H,1,8-10H2/t14-,15-,21-/m1/s1
InChIKey	QZXNKQGPMTXTDE-VTJXTGGHSA-N Google Search
Mol Weight	394.86 g/mol
Molecular Formula	C21H19ClN4O2
Exact Mass	394.119654 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	7Jd0Fu8bLOP
Name	9-[8'-(Allyloxy)-2'-phenyl-7'-oxabicyclo[3.3.0]oct-1'-en-3'-yl)-9H-6-chloropurine
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H19ClN4O2
InChI	InChI=1S/C21H19ClN4O2/c1-2-8-27-21-17-14(10-28-21)9-15(16(17)13-6-4-3-5-7-13)26-12-25-18-19(22)23-11-24-20(18)26/h2-7,11-12,14-15,21H,1,8-10H2/t14-,15-,21-/m1/s1
InChIKey	QZXNKQGPMTXTDE-VTJXTGGHSA-N
Molecular Weight	394.862 g/mol
SMILES	c12[n](cnc2c(Cl)ncn1)[C@]1(C(=C2[C@](OCC=C)(OC[C@]2(C1)[H])[H])c1ccccc1)[H]
SPLASH	splash10-054o-0910000000-99e47704437073c38085
Source of Spectrum	H-2005-1457-30
Synonyms	9-[(3R,5R,6aS)-4-phenyl-3-prop-2-enoxy-3,5,6,6a-tetrahydro-1H-cyclopenta[c]furan-5-yl]-6-chloropurine 9-[(3R,5R,6aS)-4-phenyl-3-prop-2-enoxy-3,5,6,6a-tetrahydro-1H-cyclopenta[c]furan-5-yl]-6-chloranyl-purine
Wiley ID	1562589