Cholest-3-eno[3,4-d]pyrimidine, 2'-chloro-

SpectraBase Compound ID	JEXCoEE7cvO
InChI	InChI=1S/C29H45ClN2/c1-18(2)7-6-8-19(3)22-11-12-23-21-9-10-25-26-20(17-31-27(30)32-26)13-15-29(25,5)24(21)14-16-28(22,23)4/h17-19,21-25H,6-16H2,1-5H3
InChIKey	MCPDGNPTVHLKNU-UHFFFAOYSA-N Google Search
Mol Weight	457.1 g/mol
Molecular Formula	C29H45ClN2
Exact Mass	456.327127 g/mol

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SpectraBase Spectrum ID	H52yUW2Gg1d
Name
Copyright	Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C29H45ClN2
InChI	InChI=1S/C29H45ClN2/c1-18(2)7-6-8-19(3)22-11-12-23-21-9-10-25-26-20(17-31-27(30)32-26)13-15-29(25,5)24(21)14-16-28(22,23)4/h17-19,21-25H,6-16H2,1-5H3
InChIKey	MCPDGNPTVHLKNU-UHFFFAOYSA-N
Molecular Weight	456.3261
SMILES	c1nc(Cl)nc2c1CCC1(C)C2CCC2C1CCC1(C)C2CCC1C(C)CCCC(C)C
SPLASH	splash10-066v-9300000000-fceb3373a59e098f77b3
Source of Spectrum	Chemical Concepts, A Wiley Division, Weinheim, Germany