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2,2-Dimethyl-1,3-Oxathiane
[CAS# 5809-68-7]

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CAS#: 5809-68-7
Product: 2,2-Dimethyl-1,3-Oxathiane
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Identification
Name 2,2-Dimethyl-1,3-Oxathiane
Synonyms Cbmicro_034026; T0502-3540
Molecular Structure CAS#: 5809-68-7, 2,2-Dimethyl-1,3-Oxathiane
Molecular Formula C30H28N4O4
Molecular Weight 508.58
CAS Registry Number 5809-68-7
SMILES C1=C3C2=C(C=C1)C=CC=C2C(=O)N(C3=O)CCN5CCN(C4=CC=C(C=C4)\C=C(\C(OCC)=O)C#N)CC5
InChI 1S/C30H28N4O4/c1-2-38-30(37)23(20-31)19-21-9-11-24(12-10-21)33-16-13-32(14-17-33)15-18-34-28(35)25-7-3-5-22-6-4-8-26(27(22)25)29(34)36/h3-12,19H,2,13-18H2,1H3/b23-19+
InChIKey VLMDSMCCGXJMCH-FCDQGJHFSA-N
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