CID 3051552

67466-43-7

Structural Information

Molecular Formula
C11H14ClNO
SMILES
CC1CC(CN1)(C2=CC(=CC=C2)Cl)O
InChI
InChI=1S/C11H14ClNO/c1-8-6-11(14,7-13-8)9-3-2-4-10(12)5-9/h2-5,8,13-14H,6-7H2,1H3
InChIKey
DSQQQINQFJJKET-UHFFFAOYSA-N
Compound name
3-(3-chlorophenyl)-5-methylpyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.07639 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.08367 144.7
[M+Na]+ 234.06561 157.4
[M+NH4]+ 229.11021 155.1
[M+K]+ 250.03955 150.3
[M-H]- 210.06911 147.3
[M+Na-2H]- 232.05106 152.6
[M]+ 211.07584 147.6
[M]- 211.07694 147.6
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.