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

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 145.5
[M+Na]+ 234.06561 154.0
[M-H]- 210.06911 148.3
[M+NH4]+ 229.11021 166.3
[M+K]+ 250.03955 148.3
[M+H-H2O]+ 194.07365 140.2
[M+HCOO]- 256.07459 160.1
[M+CH3COO]- 270.09024 157.7
[M+Na-2H]- 232.05106 148.9
[M]+ 211.07584 142.6
[M]- 211.07694 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.