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(+)-Secobarbital

View entire compound with spectra: 11 MS (GC)

(+)-Secobarbital
SpectraBase Compound ID 8nDNwRkuNIL
InChI InChI=1S/C12H18N2O3/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17)/t8-/m1/s1
InChIKey KQPKPCNLIDLUMF-MRVPVSSYSA-N
Mol Weight 238.29 g/mol
Molecular Formula C12H18N2O3
Exact Mass 238.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PttlDkemom
Name (+)-Secobarbital
Alternate Name(s) (R)-(+)-Seconal 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-(1-methylbutyl)-5-(2-propenyl)-, (R)- 2,4,6(1H,3H,5H)-Pyrimidinitrione, 5-(1-methylbutyl)-5-(2-propenyl)- 5-(1-Methylbutyl)-5-(2-propenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione 5-Allyl-5-(1-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione 5-Allyl-5-(1-methylbutyl)barbiturate 5-Allyl-5-(1-methylbutyl)barbituric acid 5-Allyl-5-(1-methylbutyl)hexahydropyrimidine-2,4,6-trione 5-Allyl-5-(1-methylbutyl)malonylurea 5-Pentan-2-yl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione Barbituric acid, 5-allyl-5-(1-methylbutyl)- Barbituric acid, 5-allyl-5-(1-methylbutyl)-, (R)-(+)- Secobarbital Barbosec Evronal Hypotrol Hyptran Imesonal Immenoctal Immenox Meballymal Meballymalum Pramil Quinalbarbital Quinalbarbitone R(+)-5-allyl-5-(1-methylbutyl)-barbituric acid R(+)-Secobarbital secobarbital suppository dosage form Secobarbitale Secobarbitalum Secobarbitone Seconal Seotal Somosal Trisomnin BRN 0225330 DEA NO. 2315 DEA NO. 2316 EINECS 200-982-2 HSDB 3182
CAS Registry Number 22328-94-5
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Formula C12H18N2O3
InChI InChI=1S/C12H18N2O3/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17)/t8-/m1/s1
InChIKey KQPKPCNLIDLUMF-MRVPVSSYSA-N
Molecular Weight 238.287 g/mol
SMILES N1C(C(C(NC1=O)=O)([C@@](CCC)(C)[H])CC=C)=O
SPLASH splash10-014i-7900000000-1fd7ca0cc08111e967dc
Source of Spectrum JC-530-313-28
Wiley ID 1240334