Spectrum KO003975 for Spermidine

Rating: (*)★(*)★(*)★(*)★(*)☆

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/C7H19N3/c8-4-1-2-6-10-7-3-5-9/h10H,1-9H2
ATHGHQPFGPMSJY-UHFFFAOYSA-N
C7H19N3
145.15789760799998
NCCCNCCCCN

Mass Spectral Metadata

NameValue
KO003975
2016.01.19 (Created 2007.07.07, modified 2011.05.10)
Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
CC BY-NC-SA
KEIO_ID S003
145.1579
API3000, Applied Biosystems
LC-ESI-QQ
MS2
40 V
positive
1.1244415256959157
0.37534780247966987
146
[M+H]+
1136.0795068492125 ppm
-0.165867607999985 Da