CID 14153814

1-methyl-4-[(methylamino)methyl]piperidin-4-ol

Structural Information

Molecular Formula
C8H18N2O
SMILES
CNCC1(CCN(CC1)C)O
InChI
InChI=1S/C8H18N2O/c1-9-7-8(11)3-5-10(2)6-4-8/h9,11H,3-7H2,1-2H3
InChIKey
YUQFKXYKVOBONS-UHFFFAOYSA-N
Compound name
1-methyl-4-(methylaminomethyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

158.1419 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.14918 136.2
[M+Na]+ 181.13112 141.5
[M-H]- 157.13462 136.6
[M+NH4]+ 176.17572 156.8
[M+K]+ 197.10506 140.3
[M+H-H2O]+ 141.13916 130.7
[M+HCOO]- 203.14010 155.2
[M+CH3COO]- 217.15575 176.9
[M+Na-2H]- 179.11657 142.2
[M]+ 158.14135 131.5
[M]- 158.14245 131.5
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