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(1S,2S,7S,8aS)-7-Aminooctahydro-1,2-indolizinediol (7S-amino-lentiginosine)

View entire compound with spectra: 1 MS (GC)

(1S,2S,7S,8aS)-7-Aminooctahydro-1,2-indolizinediol (7S-amino-lentiginosine)
SpectraBase Compound ID 7suG0ue5tfU
InChI InChI=1S/C8H16N2O2/c9-5-1-2-10-4-7(11)8(12)6(10)3-5/h5-8,11-12H,1-4,9H2/t5-,6-,7-,8-/m0/s1
InChIKey PTRSMSVBJBHVAH-XAMCCFCMSA-N
Mol Weight 172.23 g/mol
Molecular Formula C8H16N2O2
Exact Mass 172.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IpnTZDCKlqn
Name (1S,2S,7S,8aS)-7-Aminooctahydro-1,2-indolizinediol (7S-amino-lentiginosine)
Alternate Name(s) (1S,2S,7S,8aS)-7-amino-1,2,3,5,6,7,8,8a-octahydroindolizine-1,2-diol (1S,2S,7S,8aS)-7-azanyl-1,2,3,5,6,7,8,8a-octahydroindolizine-1,2-diol
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Formula C8H16N2O2
InChI InChI=1S/C8H16N2O2/c9-5-1-2-10-4-7(11)8(12)6(10)3-5/h5-8,11-12H,1-4,9H2/t5-,6-,7-,8-/m0/s1
InChIKey PTRSMSVBJBHVAH-XAMCCFCMSA-N
Molecular Weight 172.228 g/mol
SMILES O[C@]1([C@]2(N(CC[C@@](C2)(N)[H])C[C@@]1(O)[H])[H])[H]
SPLASH splash10-0a4i-9700000000-a9e3549b5c67be8daaa8
Source of Spectrum F-67-9560-8
Wiley ID 1691367