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5-bromo AMB-PICA
SpectraBase Compound ID CaTKj9K8crb
InChI InChI=1S/C20H27BrN2O3/c1-14(2)18(20(25)26-3)22-19(24)16-13-23(12-8-4-7-11-21)17-10-6-5-9-15(16)17/h5-6,9-10,13-14,18H,4,7-8,11-12H2,1-3H3,(H,22,24)/t18-/m0/s1
InChIKey OVJGUFJEFVZXQO-SFHVURJKSA-N
Mol Weight 423.35 g/mol
Molecular Formula C20H27BrN2O3
Exact Mass 422.120506 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 1xEUEBdwsz2
Name 5-Bromo AMB-PICA
Source of Sample Cayman Chemical Company
Catalog Number 29752
Lot Number 0583810-7
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
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Formula C20H27BrN2O3
IUPAC Name Methyl (1-(5-bromopentyl)-1H-indole-3-carbonyl)-L-valinate
InChI InChI=1S/C20H27BrN2O3/c1-14(2)18(20(25)26-3)22-19(24)16-13-23(12-8-4-7-11-21)17-10-6-5-9-15(16)17/h5-6,9-10,13-14,18H,4,7-8,11-12H2,1-3H3,(H,22,24)/t18-/m0/s1
InChIKey OVJGUFJEFVZXQO-SFHVURJKSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 423.351 g/mol
Purity >=98%
SMILES N(C(c1c2c(cccc2)[n](c1)CCCCCBr)=O)[C@](C(OC)=O)(C(C)C)[H]
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms 5-Bromo MMB018; 5-Bromo MMB-PICA
Technique ATR-Neat
UV - Neutral Conditions UVmax (nm): 219, 291