CID 3051554

67466-44-8

Structural Information

Molecular Formula
C11H14ClNO
SMILES
CC1C(CCN1)(C2=CC=C(C=C2)Cl)O
InChI
InChI=1S/C11H14ClNO/c1-8-11(14,6-7-13-8)9-2-4-10(12)5-3-9/h2-5,8,13-14H,6-7H2,1H3
InChIKey
SJELVZUSNMROAT-UHFFFAOYSA-N
Compound name
3-(4-chlorophenyl)-2-methylpyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

211.07639 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.083666 145.5
[M+Na]+ 234.065608 154.0
[M-H]- 210.069114 148.3
[M+NH4]+ 229.110213 166.3
[M+K]+ 250.039548 148.3
[M+H-H2O]+ 194.073650 140.2
[M+HCOO]- 256.074591 160.1
[M+CH3COO]- 270.090241 157.7
[M+Na-2H]- 232.051056 148.9
[M]+ 211.07584142 142.6
[M]- 211.07693858 142.6
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.