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

CAS No.
CCD No.
CCD08071532
Formula
C15 H24 N O2 . C6 H2 N3 O7
MolWeight
478.455

Basic Information

Product Name: 6-METHOXY-2-METHYL-1-(2-METHYLPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-2-IUM-7-OL, 2,4,6-TRINITROPHENOLATE
English Synonyms: 6-METHOXY-2-METHYL-1-(2-METHYLPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-2-IUM-7-OL, 2,4,6-TRINITROPHENOLATE
MDL Number.: MFCD01444696
H bond acceptor: 3
H bond donor: 2
Smile: CC(C)CC1c2cc(c(cc2CC[NH+]1C)OC)O.c1c(cc(c(c1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]
InChi: InChI=1S/C15H23NO2.C6H3N3O7/c1-10(2)7-13-12-9-14(17)15(18-4)8-11(12)5-6-16(13)3;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h8-10,13,17H,5-7H2,1-4H3;1-2,10H
InChiKey: InChIKey=MLDQZIQHGCUYQX-UHFFFAOYSA-N

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