CID 13593114

(2s)-2-(chloromethyl)pyrrolidine hydrochloride

Structural Information

Molecular Formula
C5H10ClN
SMILES
C1C[C@H](NC1)CCl
InChI
InChI=1S/C5H10ClN/c6-4-5-2-1-3-7-5/h5,7H,1-4H2/t5-/m0/s1
InChIKey
KFINMADAIKCLDI-YFKPBYRVSA-N
Compound name
(2S)-2-(chloromethyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

119.05018 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 120.05746 124.2
[M+Na]+ 142.03940 131.4
[M-H]- 118.04290 124.3
[M+NH4]+ 137.08400 146.9
[M+K]+ 158.01334 128.3
[M+H-H2O]+ 102.04744 119.1
[M+HCOO]- 164.04838 140.2
[M+CH3COO]- 178.06403 164.1
[M+Na-2H]- 140.02485 128.9
[M]+ 119.04963 120.6
[M]- 119.05073 120.6
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

patents stripe