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3,3'-(butane-1,4-diyl)bis(1-methyl-2-(2-oxopyrrolidin-1-yl)-2,3-dihydrobenzo[d][1,3,2]diazaphosphinin-4(1H)-one)
SpectraBase Compound ID A22Td3fA58e
InChI InChI=1S/C28H34N6O4P2/c1-29-23-13-5-3-11-21(23)27(37)33(39(29)31-19-9-15-25(31)35)17-7-8-18-34-28(38)22-12-4-6-14-24(22)30(2)40(34)32-20-10-16-26(32)36/h3-6,11-14H,7-10,15-20H2,1-2H3
InChIKey AIBIEYPJKLNLEM-UHFFFAOYSA-N
Mol Weight 580.6 g/mol
Molecular Formula C28H34N6O4P2
Exact Mass 580.211678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DsExhTCIKkz
Name 3,3'-(butane-1,4-diyl)bis(1-methyl-2-(2-oxopyrrolidin-1-yl)-2,3-dihydrobenzo[d][1,3,2]diazaphosphinin-4(1H)-one)
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Formula C28H34N6O4P2
InChI InChI=1S/C28H34N6O4P2/c1-29-23-13-5-3-11-21(23)27(37)33(39(29)31-19-9-15-25(31)35)17-7-8-18-34-28(38)22-12-4-6-14-24(22)30(2)40(34)32-20-10-16-26(32)36/h3-6,11-14H,7-10,15-20H2,1-2H3
InChIKey AIBIEYPJKLNLEM-UHFFFAOYSA-N
Molecular Weight 580.566 g/mol
SMILES C(CN1C(c2ccccc2N(P1N1CCCC1=O)C)=O)CCN1C(c2c(N(C)P1N1C(=O)CCC1)cccc2)=O
SPLASH splash10-01r2-0300900000-dd6cd3ad9067e9b8f28a
Source of Spectrum DZ-626-1770-3f
Wiley ID 1798295