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1H-Cyclopentapyrimidine-2,4(3H,4aH)-dione, 3-(2-chlorophenyl)tetrahydro-, cis-
SpectraBase Compound ID GjmqL1hcDHT
InChI InChI=1S/C13H13ClN2O2/c14-9-5-1-2-7-11(9)16-12(17)8-4-3-6-10(8)15-13(16)18/h1-2,5,7-8,10H,3-4,6H2,(H,15,18)/t8-,10+/m0/s1
InChIKey GXWWGJGWNCIXKZ-WCBMZHEXSA-N
Mol Weight 264.71 g/mol
Molecular Formula C13H13ClN2O2
Exact Mass 264.066555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9mCE7Hc6EwA
Name 1H-Cyclopentapyrimidine-2,4(3H,4aH)-dione, 3-(2-chlorophenyl)tetrahydro-, cis-
Alternate Name(s) (4aS,7aR)-3-(2-chlorophenyl)tetrahydro-1H-cyclopenta[d]pyrimidine-2,4(3H,4aH)-dione N(3)-(o-chlorophenyl)-cis-cyclopenta[5,6-a]hexahydropyrimidine-2,4-dione
CAS Registry Number 128668-92-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClN2O2
InChI InChI=1S/C13H13ClN2O2/c14-9-5-1-2-7-11(9)16-12(17)8-4-3-6-10(8)15-13(16)18/h1-2,5,7-8,10H,3-4,6H2,(H,15,18)/t8-,10+/m0/s1
InChIKey GXWWGJGWNCIXKZ-WCBMZHEXSA-N
Molecular Weight 264.712 g/mol
SMILES N1[C@]2([C@@](C(N(C1=O)c1c(Cl)cccc1)=O)(CCC2)[H])[H]
SPLASH splash10-004i-7290000000-2bff7add5cde32c2ff85
Source of Spectrum O-25-278-2
Wiley ID 1267646