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2-PROPYLTHIOCARBAMATO-6-(1,1-DIMETHYLETHYL)-3-CYCLOHEXYL-3,4-DIHYDRO-2H-1,3,2-BENZOXAZAPHOSPHORINE-2-OXIDE
SpectraBase Compound ID IwH5J4Ii7AG
InChI InChI=1S/C21H33N2O3PS/c1-5-13-28-20(24)22-27(25)23(18-9-7-6-8-10-18)15-16-14-17(21(2,3)4)11-12-19(16)26-27/h11-12,14,18H,5-10,13,15H2,1-4H3,(H,22,24,25)
InChIKey RHYPMQDPGDILNB-UHFFFAOYSA-N
Mol Weight 424.5 g/mol
Molecular Formula C21H33N2O3PS
Exact Mass 424.194951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HwGZ4SvUVF
Name 2-[(Propyl)hiocarbamato]-6-(1',1'-dimethylethyl)-3-cyclohexyl-3,4-dihydro-2H-(1,3,2)-benzoxaphosphorine - 2-Oxide
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Formula C21H33N2O3PS
InChI InChI=1S/C21H33N2O3PS/c1-5-13-28-20(24)22-27(25)23(18-9-7-6-8-10-18)15-16-14-17(21(2,3)4)11-12-19(16)26-27/h11-12,14,18H,5-10,13,15H2,1-4H3,(H,22,24,25)
InChIKey RHYPMQDPGDILNB-UHFFFAOYSA-N
Molecular Weight 424.540 g/mol
SMILES N(P1(N(Cc2c(O1)ccc(C(C)(C)C)c2)C1CCCCC1)=O)C(=O)SCCC
SPLASH splash10-0bt9-9673000000-cec66620f6984ba40371
Source of Spectrum Y-39-1042-0
Synonyms N-(6-tert-butyl-3-cyclohexyl-2-oxo-4H-1,3,2$l^{5}-benzoxazaphosphorin-2-yl)carbamothioic acid S-propyl ester S-propyl N-(6-tert-butyl-3-cyclohexyl-2-oxo-4H-1,3,2$l^{5}-benzoxazaphosphinin-2-yl)carbamothioate S-propyl N-(6-tert-butyl-3-cyclohexyl-2-oxidanylidene-4H-1,3,2$l^{5}-benzoxazaphosphinin-2-yl)carbamothioate
Wiley ID 1528630