belladonnine, sulfate(1:2)(salt)

SpectraBase Compound ID	6nQjyECl03Z
InChI	InChI=1S/C34H42N2O4.2H2O4S/c1-35-23-12-13-24(35)19-27(18-23)39-32(37)30-16-17-34(22-8-4-3-5-9-22,31-11-7-6-10-29(30)31)33(38)40-28-20-25-14-15-26(21-28)36(25)2;21-5(2,3)4/h3-11,23-28,30H,12-21H2,1-2H3;2(H2,1,2,3,4)/t23-,24+,25-,26+,27+,28+,30-,34-;;/m0../s1
InChIKey	WPGNEEIURMNIMQ-ROOCDNBTSA-N Google Search
Mol Weight	738.86 g/mol
Molecular Formula	C34H46N2O12S2
Exact Mass	738.249217 g/mol

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SpectraBase Spectrum ID	7hEGZNjseAV
Name	BELLADONNINE, SULFATE (1:2) (SALT)
Source of Sample	Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Catalog Number	B 674
Copyright	Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C34H46N2O12S2
InChI	InChI=1S/C34H42N2O4.2H2O4S/c1-35-23-12-13-24(35)19-27(18-23)39-32(37)30-16-17-34(22-8-4-3-5-9-22,31-11-7-6-10-29(30)31)33(38)40-28-20-25-14-15-26(21-28)36(25)2;21-5(2,3)4/h3-11,23-28,30H,12-21H2,1-2H3;2(H2,1,2,3,4)/t23-,24+,25-,26+,27+,28+,30-,34-;;/m0../s1
InChIKey	WPGNEEIURMNIMQ-ROOCDNBTSA-N
Molecular Weight	738.865 g/mol
Synonyms	BELLADONNINE, SULFATE /1 TO 2/ /SALT/ TROPAN-3A-OL, 1AH,5AH-, 1-PHENYL- 1,2,3,4-TETRAHYDRO-1,4-NAPHTHALENEDI- CARBOXYLATE /ESTER/ /2 TO 1/, SULFATE /1 TO 2/ /SALT/
Technique	KBr WAFER