CID 14578459

3-[(dimethylamino)methyl]pyrrolidin-3-ol dihydrochloride

Structural Information

Molecular Formula
C7H16N2O
SMILES
CN(C)CC1(CCNC1)O
InChI
InChI=1S/C7H16N2O/c1-9(2)6-7(10)3-4-8-5-7/h8,10H,3-6H2,1-2H3
InChIKey
WWPGEZLKLDDXQP-UHFFFAOYSA-N
Compound name
3-[(dimethylamino)methyl]pyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

144.12627 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.133546 132.5
[M+Na]+ 167.115488 137.8
[M-H]- 143.118994 133.0
[M+NH4]+ 162.160093 155.1
[M+K]+ 183.089428 137.3
[M+H-H2O]+ 127.123530 127.1
[M+HCOO]- 189.124471 152.9
[M+CH3COO]- 203.140121 173.3
[M+Na-2H]- 165.100936 137.2
[M]+ 144.12572142 128.4
[M]- 144.12681858 128.4
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