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(1S,5S,7R)-3-(phenylmethyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid methyl ester
SpectraBase Compound ID 5YJWwN8E0kk
InChI InChI=1S/C14H17NO4/c1-17-14(16)13-11-8-15(9-12(18-11)19-13)7-10-5-3-2-4-6-10/h2-6,11-13H,7-9H2,1H3/t11-,12-,13+/m0/s1
InChIKey VCIUSTQAFLLEKV-RWMBFGLXSA-N
Mol Weight 263.29 g/mol
Molecular Formula C14H17NO4
Exact Mass 263.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CACkpKzpMF1
Name (1S,5S,7R)-3-(phenylmethyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid methyl ester
Alternate Name(s) (1S,5S,7R)-3-benzyl-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid methyl ester methyl (1S,5S,7R)-3-(phenylmethyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylate methyl (1S,5S,7R)-3-benzyl-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO4
InChI InChI=1S/C14H17NO4/c1-17-14(16)13-11-8-15(9-12(18-11)19-13)7-10-5-3-2-4-6-10/h2-6,11-13H,7-9H2,1H3/t11-,12-,13+/m0/s1
InChIKey VCIUSTQAFLLEKV-RWMBFGLXSA-N
Molecular Weight 263.293 g/mol
SMILES [C@]12(CN(C[C@](O[C@]2(C(=O)OC)[H])(O1)[H])Cc1ccccc1)[H]
SPLASH splash10-0006-9000000000-e1d946fa8e51c2ccd507
Source of Spectrum J-64-7360-16
Wiley ID 1531113