CID 103985007

[3-(methoxymethyl)pyrrolidin-3-yl]methanol

Structural Information

Molecular Formula
C7H15NO2
SMILES
COCC1(CCNC1)CO
InChI
InChI=1S/C7H15NO2/c1-10-6-7(5-9)2-3-8-4-7/h8-9H,2-6H2,1H3
InChIKey
PHOYKIABUKOWQG-UHFFFAOYSA-N
Compound name
[3-(methoxymethyl)pyrrolidin-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

145.11028 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.11756 132.4
[M+Na]+ 168.09950 138.5
[M-H]- 144.10300 131.4
[M+NH4]+ 163.14410 154.7
[M+K]+ 184.07344 137.0
[M+H-H2O]+ 128.10754 127.5
[M+HCOO]- 190.10848 151.5
[M+CH3COO]- 204.12413 167.1
[M+Na-2H]- 166.08495 137.5
[M]+ 145.10973 129.3
[M]- 145.11083 129.3
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