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2-Methanesulfonyl-3-trifluoromethyl-2-aza-bicyclo[2.2.1]hept-5-ene-3-carboxylic acid, methyl ester
SpectraBase Compound ID 4cJBBehTQ0J
InChI InChI=1S/C10H12F3NO4S/c1-18-8(15)9(10(11,12)13)6-3-4-7(5-6)14(9)19(2,16)17/h3-4,6-7H,5H2,1-2H3/t6-,7+,9+/m0/s1
InChIKey GPOZIVMTTYMMSW-LKEWCRSYSA-N
Mol Weight 299.26 g/mol
Molecular Formula C10H12F3NO4S
Exact Mass 299.043914 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVCoB3uXfjB
Name 2-Methanesulfonyl-3-trifluoromethyl-2-aza-bicyclo[2.2.1]hept-5-ene-3-carboxylic acid, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12F3NO4S
InChI InChI=1S/C10H12F3NO4S/c1-18-8(15)9(10(11,12)13)6-3-4-7(5-6)14(9)19(2,16)17/h3-4,6-7H,5H2,1-2H3/t6-,7+,9+/m0/s1
InChIKey GPOZIVMTTYMMSW-LKEWCRSYSA-N
Molecular Weight 299.264 g/mol
SMILES [C@]1(N(S(=O)(=O)C)[C@]2(C[C@@]1(C=C2)[H])[H])(C(F)(F)F)C(=O)OC
SPLASH splash10-02t9-9420000000-d995113d133b7f7b57bb
Synonyms 3-Mesyl-2-(trifluoromethyl)-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylic acid methyl ester 3-Methylsulfonyl-2-(trifluoromethyl)-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylic acid methyl ester Methyl 2-(methylsulfonyl)-3-(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-ene-3-carboxylate Methyl 3-methylsulfonyl-2-(trifluoromethyl)-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylate
Wiley ID 1441189