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(1'S,2S,2'S,5'S)-2-[(Ethoxycarbonyl)amino]-4-methylpentanoic acid 5-methylbicyclo[3.2.0]hept-2-yl ester
SpectraBase Compound ID HglnWQIqPmX
InChI InChI=1S/C17H29NO4/c1-5-21-16(20)18-13(10-11(2)3)15(19)22-14-7-9-17(4)8-6-12(14)17/h11-14H,5-10H2,1-4H3,(H,18,20)/t12-,13+,14+,17+/m1/s1
InChIKey WGNZDNMHROHFQO-FHIRATQRSA-N
Mol Weight 311.42 g/mol
Molecular Formula C17H29NO4
Exact Mass 311.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83TOod2coGQ
Name (1'S,2S,2'S,5'S)-2-[(Ethoxycarbonyl)amino]-4-methylpentanoic acid 5-methylbicyclo[3.2.0]hept-2-yl ester
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Formula C17H29NO4
InChI InChI=1S/C17H29NO4/c1-5-21-16(20)18-13(10-11(2)3)15(19)22-14-7-9-17(4)8-6-12(14)17/h11-14H,5-10H2,1-4H3,(H,18,20)/t12-,13+,14+,17+/m1/s1
InChIKey WGNZDNMHROHFQO-FHIRATQRSA-N
Molecular Weight 311.422 g/mol
SMILES N(C(=O)OCC)[C@](C(O[C@@]1([C@@]2([C@](C)(CC1)CC2)[H])[H])=O)(CC(C)C)[H]
SPLASH splash10-0a4i-4910000000-1113fd5f7c9cf7cd93b4
Source of Spectrum J-60-7265-32
Synonyms (1S,2S,5S)-5-methylbicyclo[3.2.0]hept-2-yl (2S)-2-[(ethoxycarbonyl)amino]-4-methylpentanoate (2S)-2-(carbethoxyamino)-4-methyl-valeric acid[(1S,2S,5S)-5-methyl-2-bicyclo[3.2.0]heptanyl]ester (2S)-2-(ethoxycarbonylamino)-4-methylpentanoic acid[(1S,2S,5S)-5-methyl-2-bicyclo[3.2.0]heptanyl]ester [(1S,2S,5S)-5-methyl-2-bicyclo[3.2.0]heptanyl](2S)-2-(ethoxycarbonylamino)-4-methyl-pentanoate (2S)-2-(ethoxycarbonylamino)-4-methylpentanoic acid [(1S,2S,5S)-5-methyl-2-bicyclo[3.2.0]heptanyl] ester [(1S,2S,5S)-5-methyl-2-bicyclo[3.2.0]heptanyl] (2S)-2-(ethoxycarbonylamino)-4-methylpentanoate [(1S,2S,5S)-5-methyl-2-bicyclo[3.2.0]heptanyl] (2S)-2-(ethoxycarbonylamino)-4-methyl-pentanoate
Wiley ID 1312443