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Methyl cis-5-(2-iodoethyl)-2-[1-[(N-methylmethanesufonamido)methyl]-1-(E)-propenyl]-1,2-dihydropyrido[1,2-a]indole-1-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl cis-5-(2-iodoethyl)-2-[1-[(N-methylmethanesufonamido)methyl]-1-(E)-propenyl]-1,2-dihydropyrido[1,2-a]indole-1-carboxylate
SpectraBase Compound ID 9L4F1PVRiCY
InChI InChI=1S/C22H27IN2O4S/c1-5-15(14-24(2)30(4,27)28)16-10-11-20-18(12-13-23)17-8-6-7-9-19(17)25(20)21(16)22(26)29-3/h5-11,16,21H,12-14H2,1-4H3/b15-5-/t16-,21-/m1/s1
InChIKey OMWHOUJJIQKZFM-ZSEONTDLSA-N
Mol Weight 542.43 g/mol
Molecular Formula C22H27IN2O4S
Exact Mass 542.073624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xcVGciWqe
Name Methyl cis-5-(2-iodoethyl)-2-[1-[(N-methylmethanesufonamido)methyl]-1-(E)-propenyl]-1,2-dihydropyrido[1,2-a]indole-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27IN2O4S
InChI InChI=1S/C22H27IN2O4S/c1-5-15(14-24(2)30(4,27)28)16-10-11-20-18(12-13-23)17-8-6-7-9-19(17)25(20)21(16)22(26)29-3/h5-11,16,21H,12-14H2,1-4H3/b15-5-/t16-,21-/m1/s1
InChIKey OMWHOUJJIQKZFM-ZSEONTDLSA-N
Molecular Weight 542.432 g/mol
SMILES c12[n](c3c(c2CCI)cccc3)[C@]([C@](C=C1)(\C(CN(S(=O)(=O)C)C)=C/C)[H])(C(=O)OC)[H]
SPLASH splash10-001i-0790310000-1c46b4c8c36e964416fe
Source of Spectrum J-58-7765-31
Wiley ID 1404787