CID 12793177

(4-methylpiperazin-2-yl)methanol

Structural Information

Molecular Formula
C6H14N2O
SMILES
CN1CCNC(C1)CO
InChI
InChI=1S/C6H14N2O/c1-8-3-2-7-6(4-8)5-9/h6-7,9H,2-5H2,1H3
InChIKey
JVIKJOXETSHPGJ-UHFFFAOYSA-N
Compound name
(4-methylpiperazin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

274
Patents

130.11061 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.11789 130.1
[M+Na]+ 153.09983 135.8
[M-H]- 129.10333 127.6
[M+NH4]+ 148.14443 148.1
[M+K]+ 169.07377 133.9
[M+H-H2O]+ 113.10787 123.7
[M+HCOO]- 175.10881 145.9
[M+CH3COO]- 189.12446 166.6
[M+Na-2H]- 151.08528 135.1
[M]+ 130.11006 123.7
[M]- 130.11116 123.7
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