2-Benzyl-1-methyl (1R,5R,6S)-5-Hydroxy-2-azabicyclo[4.1.0]heptane-1,2-dicarboxylate

SpectraBase Compound ID	K75s9fBUKGE
InChI	InChI=1S/C16H19NO5/c1-21-14(19)16-9-12(16)13(18)7-8-17(16)15(20)22-10-11-5-3-2-4-6-11/h2-6,12-13,18H,7-10H2,1H3/t12-,13-,16-/m1/s1
InChIKey	BZZRNZBIVLVYHN-XJKCOSOUSA-N Google Search
Mol Weight	305.33 g/mol
Molecular Formula	C16H19NO5
Exact Mass	305.126323 g/mol

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SpectraBase Spectrum ID	Cd07mUn5Ce7
Name	2-Benzyl-1-methyl (1R,5R,6S)-5-Hydroxy-2-azabicyclo[4.1.0]heptane-1,2-dicarboxylate
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H19NO5
InChI	InChI=1S/C16H19NO5/c1-21-14(19)16-9-12(16)13(18)7-8-17(16)15(20)22-10-11-5-3-2-4-6-11/h2-6,12-13,18H,7-10H2,1H3/t12-,13-,16-/m1/s1
InChIKey	BZZRNZBIVLVYHN-XJKCOSOUSA-N
Molecular Weight	305.330 g/mol
SMILES	O[C@]1([C@@]2([C@](N(C(OCc3ccccc3)=O)CC1)(C2)C(=O)OC)[H])[H]
SPLASH	splash10-0a4i-0009000000-e066b79f10920be94e44
Source of Spectrum	U1-2011-6549-10
Synonyms	(1S,2R,6R)-2-hydroxy-5-azabicyclo[4.1.0]heptane-5,6-dicarboxylic acid O6-methyl ester O5-(phenylmethyl) ester 5-O-benzyl 6-O-methyl (1S,2R,6R)-2-hydroxy-5-azabicyclo[4.1.0]heptane-5,6-dicarboxylate O5-benzyl O6-methyl (1S,2R,6R)-2-hydroxy-5-azabicyclo[4.1.0]heptane-5,6-dicarboxylate O6-methyl O5-(phenylmethyl) (1S,2R,6R)-2-oxidanyl-5-azabicyclo[4.1.0]heptane-5,6-dicarboxylate
Wiley ID	1702982