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[(6-bromochroman-4-ylidene)amino] 4-methylbenzenesulfonate
SpectraBase Compound ID 5R36dCLOvUM
InChI InChI=1S/C16H14BrNO4S/c1-11-2-5-13(6-3-11)23(19,20)22-18-15-8-9-21-16-7-4-12(17)10-14(15)16/h2-7,10H,8-9H2,1H3
InChIKey XRWHXNFOLZMBQS-UHFFFAOYSA-N
Mol Weight 396.26 g/mol
Molecular Formula C16H14BrNO4S
Exact Mass 394.982692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fRyg8pxMns
Name [(6-bromochroman-4-ylidene)amino] 4-methylbenzenesulfonate
Appearance Solid
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Formula C16H14BrNO4S
InChI InChI=1S/C16H14BrNO4S/c1-11-2-5-13(6-3-11)23(19,20)22-18-15-8-9-21-16-7-4-12(17)10-14(15)16/h2-7,10H,8-9H2,1H3
InChIKey XRWHXNFOLZMBQS-UHFFFAOYSA-N
Instrument Name LCMS
Ionization Type EI
Molecular Weight 396.255 g/mol
SMILES c1(ccc2c(c1)C(CCO2)=NOS(c1ccc(cc1)C)(=O)=O)Br
SPLASH splash10-0adj-0594000000-2e5d55e55a6a3710d143
Source of Spectrum JP2017510553A
Wiley ID 1855301