SpectraBase Spectrum ID |
B0tT3ELprWq |
Name |
(3S,4R)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid methyl ester |
Carrier Gas |
Helium |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
303.147058156 u |
Formula |
C17H21NO4 |
GC Column |
EC-5 (30 m ?? 0.32 mm, film thickness 1.00 micrometer) |
GC Oven Program |
Oven temp 280oC |
InChI |
InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14-,15+/m0/s1 |
InChIKey |
ZPUCINDJVBIVPJ-LJISPDSOSA-N |
Inlet Type |
Splitless |
Instrument Name |
Shimadzu GC-17A |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/jssc.200800117 |
Quality |
788 |
SMILES |
CN1[C@@]2(CC[C@]1(C[C@@]([C@@]2(C(=O)OC)[H])(OC(=O)C1=CC=CC=C1)[H])[H])[H] |
SPLASH |
splash10-001i-9300000000-d746647418c2daf5ec2c |
Source of Spectrum |
SEP-31-2448-Cocaine (DOI: 10.1002/jssc.200800117) |
Wiley ID |
1909612 |