CID 19382188

(3-methoxypyrrolidin-3-yl)methanol hydrochloride

Structural Information

Molecular Formula
C6H13NO2
SMILES
COC1(CCNC1)CO
InChI
InChI=1S/C6H13NO2/c1-9-6(5-8)2-3-7-4-6/h7-8H,2-5H2,1H3
InChIKey
IKURSYINBMLFIH-UHFFFAOYSA-N
Compound name
(3-methoxypyrrolidin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

131.09464 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.10192 128.0
[M+Na]+ 154.08386 134.4
[M-H]- 130.08736 127.2
[M+NH4]+ 149.12846 150.7
[M+K]+ 170.05780 133.3
[M+H-H2O]+ 114.09190 123.2
[M+HCOO]- 176.09284 147.4
[M+CH3COO]- 190.10849 164.0
[M+Na-2H]- 152.06931 133.5
[M]+ 131.09409 124.5
[M]- 131.09519 124.5
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