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1,1-Cyclopropanedicarboxylic acid, 2-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-, dimethyl ester, (R*,R*)-(.+-.)-
SpectraBase Compound ID 4m8ncknB44T
InChI InChI=1S/C18H20N2O4/c1-23-16(21)18(17(22)24-2)9-12(18)15-14-11(7-8-19-15)10-5-3-4-6-13(10)20-14/h3-6,12,15,19-20H,7-9H2,1-2H3/t12-,15+/m0/s1
InChIKey KWBIXGBHSVQIBT-SWLSCSKDSA-N
Mol Weight 328.37 g/mol
Molecular Formula C18H20N2O4
Exact Mass 328.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GOD5HYQ8TVT
Name 1,1-Cyclopropanedicarboxylic acid, 2-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-, dimethyl ester, (R*,R*)-(.+-.)-
Alternate Name(s) 1H-Pyrido[3,4-b]indole, 1,1-cyclopropanedicarboxylic acid deriv. Dimethyl (2R)-2-[(1R)-2,3,4,9-tetrahydro-1H-.beta.-carbolin-1-yl]-1,1-cyclopropanedicarboxylate Dimethylester of 2-(1.beta.,2,3,4-tetrahydro-.beta.-carbolin-1-yl)-1,1-cyclopropane dicarboxylic acid
CAS Registry Number 71295-72-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O4
InChI InChI=1S/C18H20N2O4/c1-23-16(21)18(17(22)24-2)9-12(18)15-14-11(7-8-19-15)10-5-3-4-6-13(10)20-14/h3-6,12,15,19-20H,7-9H2,1-2H3/t12-,15+/m0/s1
InChIKey KWBIXGBHSVQIBT-SWLSCSKDSA-N
Molecular Weight 328.368 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@]([C@]1(C(C1)(C(=O)OC)C(=O)OC)[H])(NCC2)[H]
SPLASH splash10-001i-0920000000-6c30d9d511114f258ad4
Source of Spectrum K-112-1887-0
Wiley ID 1326253