CID 18962856

(5-methylpyrrolidin-2-yl)methanol

Structural Information

Molecular Formula
C6H13NO
SMILES
CC1CCC(N1)CO
InChI
InChI=1S/C6H13NO/c1-5-2-3-6(4-8)7-5/h5-8H,2-4H2,1H3
InChIKey
JMGBOXZFLWUSLH-UHFFFAOYSA-N
Compound name
(5-methylpyrrolidin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

115.09972 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 124.7
[M+Na]+ 138.08894 133.9
[M+NH4]+ 133.13354 132.8
[M+K]+ 154.06288 130.7
[M-H]- 114.09244 124.5
[M+Na-2H]- 136.07439 128.0
[M]+ 115.09917 125.5
[M]- 115.10027 125.5
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