6,7-DIMETHOXY-2-METHYL-1-(2-METHYLPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-2-IUM, 2,4,6-TRINITROPHENOLATE

CAS No.
CCD No.
CCD08071533
Formula
C16 H26 N O2 . C6 H2 N3 O7
MolWeight
492.482

Basic Information

Product Name: 6,7-DIMETHOXY-2-METHYL-1-(2-METHYLPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-2-IUM, 2,4,6-TRINITROPHENOLATE
English Synonyms: 6,7-DIMETHOXY-2-METHYL-1-(2-METHYLPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-2-IUM, 2,4,6-TRINITROPHENOLATE
MDL Number.: MFCD01444697
H bond acceptor: 3
H bond donor: 1
Smile: CC(C)CC1c2cc(c(cc2CC[NH+]1C)OC)OC.c1c(cc(c(c1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]
InChi: InChI=1S/C16H25NO2.C6H3N3O7/c1-11(2)8-14-13-10-16(19-5)15(18-4)9-12(13)6-7-17(14)3;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h9-11,14H,6-8H2,1-5H3;1-2,10H
InChiKey: InChIKey=RSUSMLQZAUYAQL-UHFFFAOYSA-N

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