CID 1268137

66283-23-6

Structural Information

Molecular Formula
C11H22N2O
SMILES
CN1CCC[C@H]1CN2CCC[C@H]2CO
InChI
InChI=1S/C11H22N2O/c1-12-6-2-4-10(12)8-13-7-3-5-11(13)9-14/h10-11,14H,2-9H2,1H3/t10-,11-/m0/s1
InChIKey
VAUQXPBOGCJNHH-QWRGUYRKSA-N
Compound name
[(2S)-1-[[(2S)-1-methylpyrrolidin-2-yl]methyl]pyrrolidin-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

198.17322 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.18050 149.6
[M+Na]+ 221.16244 154.5
[M-H]- 197.16594 151.5
[M+NH4]+ 216.20704 168.9
[M+K]+ 237.13638 152.4
[M+H-H2O]+ 181.17048 142.1
[M+HCOO]- 243.17142 166.8
[M+CH3COO]- 257.18707 181.8
[M+Na-2H]- 219.14789 148.1
[M]+ 198.17267 144.8
[M]- 198.17377 144.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe