CID 16793089

2-(5-methylfuran-2-yl)-2-(pyrrolidin-1-yl)ethan-1-amine

Structural Information

Molecular Formula
C11H18N2O
SMILES
CC1=CC=C(O1)C(CN)N2CCCC2
InChI
InChI=1S/C11H18N2O/c1-9-4-5-11(14-9)10(8-12)13-6-2-3-7-13/h4-5,10H,2-3,6-8,12H2,1H3
InChIKey
ZYSRLRPCZLJNIW-UHFFFAOYSA-N
Compound name
2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.1419 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.14918 145.5
[M+Na]+ 217.13112 150.9
[M-H]- 193.13462 150.7
[M+NH4]+ 212.17572 165.0
[M+K]+ 233.10506 150.2
[M+H-H2O]+ 177.13916 138.6
[M+HCOO]- 239.14010 166.9
[M+CH3COO]- 253.15575 184.7
[M+Na-2H]- 215.11657 146.5
[M]+ 194.14135 142.8
[M]- 194.14245 142.8
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

No patent data available for this compound.