Spectrum VF-NPL-LTQ007655 for Huperzine A

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  • Originally submitted to the Vaniya/Fiehn Natural Products Library

Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)
C15H18N2O
242.141913196
OC=1N=C2C(=CC1)C3(N)C(=CC)C(C=C(C)C3)C2
ZRJBHWIHUMBLCN-UHFFFAOYSA-N

Mass Spectral Metadata

NameValue
35
NP_UC_2547_p07_C10_POS_iTree_02.raw
positive
Linear Ion Trap
Thermo Finnigan LTQ
Arpana Vaniya
direct infusion
3.50 kV
275 C
ESI Ion Max
1.089331081399906
0.7857862745109281
243.1095690046038
M-H
8123.628439184963 ppm
1.9749318086037988 Da