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6-Azatricyclo[3.2.0.02,4]heptane-6-carboxylic acid, 3,3-dimethyl-, methyl ester, (1.alpha.,2.beta.,4.beta.,5.alpha.)-
SpectraBase Compound ID IH23MVd8bOZ
InChI InChI=1S/C10H15NO2/c1-10(2)6-5-4-11(9(12)13-3)8(5)7(6)10/h5-8H,4H2,1-3H3/t5-,6-,7-,8-/m0/s1
InChIKey FILBNYBSMWINJZ-XAMCCFCMSA-N
Mol Weight 181.23 g/mol
Molecular Formula C10H15NO2
Exact Mass 181.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hHa5PMQANu
Name 6-Azatricyclo[3.2.0.02,4]heptane-6-carboxylic acid, 3,3-dimethyl-, methyl ester, (1.alpha.,2.beta.,4.beta.,5.alpha.)-
Alternate Name(s) methyl (1R,2R,4R,5R)-3,3-dimethyl-6-azatricyclo[3.2.0.0(2,4)]heptane-6-carboxylate Methyl(1.alpha.,2.beta.,4.beta.,5.alpha.)-3,3-dimethyl-6-azatricyclo[3.2.0.0(2,4)]heptane-6-carboxylate
CAS Registry Number 105252-69-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO2
InChI InChI=1S/C10H15NO2/c1-10(2)6-5-4-11(9(12)13-3)8(5)7(6)10/h5-8H,4H2,1-3H3/t5-,6-,7-,8-/m0/s1
InChIKey FILBNYBSMWINJZ-XAMCCFCMSA-N
Molecular Weight 181.235 g/mol
SMILES [C@]12([C@]([H])(C2(C)C)[C@@]2([C@]1(CN2C(=O)OC)[H])[H])[H]
SPLASH splash10-00lr-0900000000-a8785f11c3fe4a4db3c6
Source of Spectrum K-120-209-16
Wiley ID 1177516