CID 80992

1,2,2,5,5-pentamethylpyrrolidine

Structural Information

Molecular Formula
C9H19N
SMILES
CC1(CCC(N1C)(C)C)C
InChI
InChI=1S/C9H19N/c1-8(2)6-7-9(3,4)10(8)5/h6-7H2,1-5H3
InChIKey
KGIFNEFQLJMDQJ-UHFFFAOYSA-N
Compound name
1,2,2,5,5-pentamethylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

235
Patents

141.15175 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.15903 128.2
[M+Na]+ 164.14097 137.3
[M-H]- 140.14447 131.1
[M+NH4]+ 159.18557 155.0
[M+K]+ 180.11491 136.6
[M+H-H2O]+ 124.14901 124.6
[M+HCOO]- 186.14995 149.5
[M+CH3COO]- 200.16560 176.6
[M+Na-2H]- 162.12642 133.5
[M]+ 141.15120 127.9
[M]- 141.15230 127.9
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