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3,7-bis[bis(2-hydroxyethyl)amino]-1,4a,5,8a-tetrahydro-[1,2]oxazolo[3,4-f][2,1]benzoxazole-4,8-dione
SpectraBase Compound ID JZBH5KPMJvW
InChI InChI=1S/C16H24N4O8/c21-5-1-19(2-6-22)15-9-11(17-27-15)14(26)10-12(13(9)25)18-28-16(10)20(3-7-23)4-8-24/h11-12,17-18,21-24H,1-8H2
InChIKey SPMDRNUXUFRHHM-UHFFFAOYSA-N
Mol Weight 400.39 g/mol
Molecular Formula C16H24N4O8
Exact Mass 400.159414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLCbq7S0ILr
Name 3,7-bis[bis(2-hydroxyethyl)amino]-1,4a,5,8a-tetrahydro-[1,2]oxazolo[3,4-f][2,1]benzoxazole-4,8-dione
CAS Registry Number 132507-24-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24N4O8
InChI InChI=1S/C16H24N4O8/c21-5-1-19(2-6-22)15-9-11(17-27-15)14(26)10-12(13(9)25)18-28-16(10)20(3-7-23)4-8-24/h11-12,17-18,21-24H,1-8H2
InChIKey SPMDRNUXUFRHHM-UHFFFAOYSA-N
Molecular Weight 400.388 g/mol
SMILES N1OC(=C2C(C3C(=C(N(CCO)CCO)ON3)C(C12)=O)=O)N(CCO)CCO
SPLASH splash10-0a4i-9001000000-dac7201116f5570acfff
Source of Spectrum H-73-2154-5
Synonyms 3,7-bis[bis(2-hydroxyethyl)amino]-1,4a,5,8a-tetrahydroisoxazolo[3,4-f][2,1]benzoxazole-4,8-dione 3,7-bis[bis(2-hydroxyethyl)amino]-1,4a,5,8a-tetrahydroisoxazolo[3,4-f][2,1]benzoxazole-4,8-quinone
Wiley ID 1369220