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2,3,4-Triazatricyclo[3.2.1.0(2,4)]octane-3-carboxylic acid, ethyl ester
SpectraBase Compound ID 82zKiSwG3Wv
InChI InChI=1S/C8H13N3O2/c1-2-13-8(12)11-9-6-3-4-7(5-6)10(9)11/h6-7H,2-5H2,1H3
InChIKey PFEWBNNXCZXQHK-UHFFFAOYSA-N
Mol Weight 183.21 g/mol
Molecular Formula C8H13N3O2
Exact Mass 183.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HZXvouLNnWn
Name 2,3,4-Triazatricyclo[3.2.1.0(2,4)]octane-3-carboxylic acid, ethyl ester
CAS Registry Number 85812-11-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13N3O2
InChI InChI=1S/C8H13N3O2/c1-2-13-8(12)11-9-6-3-4-7(5-6)10(9)11/h6-7H,2-5H2,1H3
InChIKey PFEWBNNXCZXQHK-UHFFFAOYSA-N
Molecular Weight 183.211 g/mol
SMILES C12N3N(N3C(CC2)C1)C(=O)OCC
SPLASH splash10-066u-9100000000-742b6a2bb5b1338b942f
Source of Spectrum H-65-2693-0
Synonyms Ethyl 2,3,4-triazatricyclo[3.2.1.0(2,4)]octane-3-carboxylate Ethyl ester of 2,3-(cis-1,3-cyclopentylene)triaziridin-1-carboxylic acid
Wiley ID 1179567