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

3
Patents

157.14667 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.15395 136.4
[M+Na]+ 180.13589 144.0
[M-H]- 156.13939 141.0
[M+NH4]+ 175.18049 154.3
[M+K]+ 196.10983 143.3
[M+H-H2O]+ 140.14393 131.4
[M+HCOO]- 202.14487 159.5
[M+CH3COO]- 216.16052 185.1
[M+Na-2H]- 178.12134 142.7
[M]+ 157.14612 140.4
[M]- 157.14722 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