CID 90658302

2-methyl-3-pentyl-4,5-dihydro-3h-pyrrole

Structural Information

Molecular Formula
C10H19N
SMILES
CCCCCC1CCN=C1C
InChI
InChI=1S/C10H19N/c1-3-4-5-6-10-7-8-11-9(10)2/h10H,3-8H2,1-2H3
InChIKey
SYVGKQQCYXDCKB-UHFFFAOYSA-N
Compound name
5-methyl-4-pentyl-3,4-dihydro-2H-pyrrole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

0
Patents

153.15175 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.15903 136.7
[M+Na]+ 176.14097 143.5
[M-H]- 152.14447 138.4
[M+NH4]+ 171.18557 158.6
[M+K]+ 192.11491 141.9
[M+H-H2O]+ 136.14901 130.5
[M+HCOO]- 198.14995 158.9
[M+CH3COO]- 212.16560 178.8
[M+Na-2H]- 174.12642 140.3
[M]+ 153.15120 137.1
[M]- 153.15230 137.1
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.