CID 61269370

N-(oxan-4-ylmethyl)cyclopropanamine

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC1NCC2CCOCC2
InChI
InChI=1S/C9H17NO/c1-2-9(1)10-7-8-3-5-11-6-4-8/h8-10H,1-7H2
InChIKey
SFEIRCQPYYEWEJ-UHFFFAOYSA-N
Compound name
N-(oxan-4-ylmethyl)cyclopropanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

155.13101 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 132.8
[M+Na]+ 178.12023 138.4
[M-H]- 154.12373 140.1
[M+NH4]+ 173.16483 147.1
[M+K]+ 194.09417 138.1
[M+H-H2O]+ 138.12827 125.9
[M+HCOO]- 200.12921 153.8
[M+CH3COO]- 214.14486 181.2
[M+Na-2H]- 176.10568 140.0
[M]+ 155.13046 131.1
[M]- 155.13156 131.1
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