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N-{(2S)-2-Azido-3-perfluoropropylpropanoyl}-(1S,2R,4R)-bornane-10,2-sultam
SpectraBase Compound ID ARWW9kgpFuF
InChI InChI=1S/C16H19F7N4O3S/c1-12(2)8-3-4-13(12)7-31(29,30)27(10(13)5-8)11(28)9(25-26-24)6-14(17,18)15(19,20)16(21,22)23/h8-10H,3-7H2,1-2H3/t8-,9+,10+,13-/m1/s1
InChIKey HOQABTJCHKNDKC-KEPMVKOISA-N
Mol Weight 480.4 g/mol
Molecular Formula C16H19F7N4O3S
Exact Mass 480.106609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4t4SD52mPk
Name N-{(2S)-2-Azido-3-perfluoropropylpropanoyl}-(1S,2R,4R)-bornane-10,2-sultam
Alternate Name(s) (S)-2-azido-1-((3aS,6R,7aR)-8,8-dimethyl-2,2-dioxidohexahydro-1H-3a,6-methanobenzo[c]isothiazol-1-yl)-4,4,5,5,6,6,6-heptafluorohexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19F7N4O3S
InChI InChI=1S/C16H19F7N4O3S/c1-12(2)8-3-4-13(12)7-31(29,30)27(10(13)5-8)11(28)9(25-26-24)6-14(17,18)15(19,20)16(21,22)23/h8-10H,3-7H2,1-2H3/t8-,9+,10+,13-/m1/s1
InChIKey HOQABTJCHKNDKC-KEPMVKOISA-N
Molecular Weight 480.402 g/mol
SMILES C(F)(F)(C[C@@](C(N1S(C[C@]23CC[C@@]([H])(C3(C)C)C[C@]12[H])(=O)=O)=O)(N=[N+]=[N-])[H])C(F)(F)C(F)(F)F
SPLASH splash10-000f-5890000000-69dbb90c26b3b597fbd0
Source of Spectrum A1-9-2513/SMS8-18
Wiley ID 1758184