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3-(Pyrrolidin-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl trifluoromethanesulfonate
SpectraBase Compound ID CWJGuRlQxBG
InChI InChI=1S/C14H16F3NO5S/c15-14(16,17)24(19,20)23-10-3-4-12-13(7-10)22-11(9-21-12)8-18-5-1-2-6-18/h3-4,7,11H,1-2,5-6,8-9H2
InChIKey QZUOJUTXJWIDGJ-UHFFFAOYSA-N
Mol Weight 367.34 g/mol
Molecular Formula C14H16F3NO5S
Exact Mass 367.070128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cb5oRaGr1r1
Name 3-(Pyrrolidin-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl trifluoromethanesulfonate
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Formula C14H16F3NO5S
InChI InChI=1S/C14H16F3NO5S/c15-14(16,17)24(19,20)23-10-3-4-12-13(7-10)22-11(9-21-12)8-18-5-1-2-6-18/h3-4,7,11H,1-2,5-6,8-9H2
InChIKey QZUOJUTXJWIDGJ-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 367.339 g/mol
SMILES C(N1CCCC1)C1Oc2cc(OS(C(F)(F)F)(=O)=O)ccc2OC1
SPLASH splash10-001i-9000000000-db9aab26621a82b9d439
Source of Spectrum US20110105462A1
Wiley ID 1844437