CID 47681

Indolizine, 3-(3-(diethylamino)propyl)-2-methyl-

Structural Information

Molecular Formula
C16H24N2
SMILES
CCN(CC)CCCC1=C(C=C2N1C=CC=C2)C
InChI
InChI=1S/C16H24N2/c1-4-17(5-2)11-8-10-16-14(3)13-15-9-6-7-12-18(15)16/h6-7,9,12-13H,4-5,8,10-11H2,1-3H3
InChIKey
SOBJYBWYCRWBKL-UHFFFAOYSA-N
Compound name
N,N-diethyl-3-(2-methylindolizin-3-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

244.19395 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.201226 160.0
[M+Na]+ 267.183168 168.0
[M-H]- 243.186674 164.6
[M+NH4]+ 262.227773 180.0
[M+K]+ 283.157108 164.6
[M+H-H2O]+ 227.191210 152.4
[M+HCOO]- 289.192151 184.6
[M+CH3COO]- 303.207801 202.7
[M+Na-2H]- 265.168616 164.2
[M]+ 244.19340142 165.2
[M]- 244.19449858 165.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe