CID 94252158

{1-[(diethylamino)methyl]cyclopropyl}methanol

Structural Information

Molecular Formula
C9H19NO
SMILES
CCN(CC)CC1(CC1)CO
InChI
InChI=1S/C9H19NO/c1-3-10(4-2)7-9(8-11)5-6-9/h11H,3-8H2,1-2H3
InChIKey
OKDIVZDZOAXDQB-UHFFFAOYSA-N
Compound name
[1-(diethylaminomethyl)cyclopropyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

157.14667 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.153946 136.4
[M+Na]+ 180.135888 144.0
[M-H]- 156.139394 141.0
[M+NH4]+ 175.180493 154.3
[M+K]+ 196.109828 143.3
[M+H-H2O]+ 140.143930 131.4
[M+HCOO]- 202.144871 159.5
[M+CH3COO]- 216.160521 185.1
[M+Na-2H]- 178.121336 142.7
[M]+ 157.14612142 140.4
[M]- 157.14721858 140.4
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