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(2S)-4-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-sulfanylidenebutanoic acid
SpectraBase Compound ID 5to6egqT2vt
InChI InChI=1S/C19H18N2O4S/c20-17(26)9-16(18(22)23)21-19(24)25-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-16H,9-10H2,(H2,20,26)(H,21,24)(H,22,23)/t16-/m0/s1
InChIKey BPABOVHZVOKGII-INIZCTEOSA-N
Mol Weight 370.42 g/mol
Molecular Formula C19H18N2O4S
Exact Mass 370.098728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GzvKBPrzHOn
Name (2S)-4-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-sulfanylidenebutanoic acid
Alternate Name(s) (2S)-4-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-thioxo-butyric acid (2S)-4-amino-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-sulfanylidenebutanoic acid (2S)-4-azanyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-sulfanylidene-butanoic acid
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Formula C19H18N2O4S
InChI InChI=1S/C19H18N2O4S/c20-17(26)9-16(18(22)23)21-19(24)25-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-16H,9-10H2,(H2,20,26)(H,21,24)(H,22,23)/t16-/m0/s1
InChIKey BPABOVHZVOKGII-INIZCTEOSA-N
Molecular Weight 370.423 g/mol
SMILES N([C@](C(=O)O)(CC(=S)N)[H])C(OCC1c2c(cccc2)-c2c1cccc2)=O
SPLASH splash10-00b9-0903000000-a6c14bd88fce779e649f
Source of Spectrum KC-0-3230-1
Wiley ID 831706