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Pyrrolo[2,1-b]benzoxazole-3a(1H)-acetic acid, 8-bromo-2,3,6,7-tetrahydro-5-methyl-6,7-dioxo-, ethyl ester
SpectraBase Compound ID 7yF3hbU2sMQ
InChI InChI=1S/C15H16BrNO5/c1-3-21-9(18)7-15-5-4-6-17(15)11-10(16)13(20)12(19)8(2)14(11)22-15/h3-7H2,1-2H3
InChIKey ZPLOBDYFVVEVOT-UHFFFAOYSA-N
Mol Weight 370.2 g/mol
Molecular Formula C15H16BrNO5
Exact Mass 369.021186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbguZu245y4
Name Pyrrolo[2,1-b]benzoxazole-3a(1H)-acetic acid, 8-bromo-2,3,6,7-tetrahydro-5-methyl-6,7-dioxo-, ethyl ester
CAS Registry Number 85083-37-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16BrNO5
InChI InChI=1S/C15H16BrNO5/c1-3-21-9(18)7-15-5-4-6-17(15)11-10(16)13(20)12(19)8(2)14(11)22-15/h3-7H2,1-2H3
InChIKey ZPLOBDYFVVEVOT-UHFFFAOYSA-N
Molecular Weight 370.199 g/mol
SMILES C1=2C(=C(C)C(C(C2Br)=O)=O)OC2(N1CCC2)CC(=O)OCC
SPLASH splash10-00lv-3092000000-7fa2d3c3d90a20253db9
Source of Spectrum C-105-2865-0
Synonyms 8-Bromo-9a-((ethoxycarbonyl)methyl)-1,2,3,6,7,9a-hexahydro-6,7-dioxopyrrolo(2,1-b)benzoxazole Ethyl (8-bromo-5-methyl-6,7-dioxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]benzoxazol-3a(1H)-yl)acetate
Wiley ID 1353521