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3-Tigloyloxy-6-isobutyryloxytropane

View entire compound with spectra: 1 NMR

3-Tigloyloxy-6-isobutyryloxytropane
SpectraBase Compound ID FABKSwMZ8Xu
InChI InChI=1S/C17H27NO4/c1-6-11(4)17(20)21-13-7-12-8-15(14(9-13)18(12)5)22-16(19)10(2)3/h6,10,12-15H,7-9H2,1-5H3/b11-6+/t12-,13?,14+,15?/m0/s1
InChIKey ADNCMUUXIVQCLS-ISULAIMJSA-N
Mol Weight 309.41 g/mol
Molecular Formula C17H27NO4
Exact Mass 309.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ImZX1l8wuKX
Name 3-Tigloyloxy-6-isobutyryloxytropane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.194008349 u
Formula C17H27NO4
InChI InChI=1S/C17H27NO4/c1-6-11(4)17(20)21-13-7-12-8-15(14(9-13)18(12)5)22-16(19)10(2)3/h6,10,12-15H,7-9H2,1-5H3/b11-6+/t12-,13?,14+,15?/m0/s1
InChIKey ADNCMUUXIVQCLS-ISULAIMJSA-N
Molecular Weight 309.406 g/mol
SMILES C(\C(=C\C)C)(=O)OC1C[C@]2(CC(OC(C(C)C)=O)[C@@](C1)(N2C)[H])[H]