CID 12700136

7179-89-7

Structural Information

Molecular Formula
C8H17NO
SMILES
CNCCCC1CCCO1
InChI
InChI=1S/C8H17NO/c1-9-6-2-4-8-5-3-7-10-8/h8-9H,2-7H2,1H3
InChIKey
SLKWAGFQOAXGGP-UHFFFAOYSA-N
Compound name
N-methyl-3-(oxolan-2-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

143.13101 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.138286 133.0
[M+Na]+ 166.120228 137.7
[M-H]- 142.123734 136.3
[M+NH4]+ 161.164833 154.5
[M+K]+ 182.094168 138.1
[M+H-H2O]+ 126.128270 127.3
[M+HCOO]- 188.129211 155.9
[M+CH3COO]- 202.144861 175.9
[M+Na-2H]- 164.105676 138.7
[M]+ 143.13046142 131.5
[M]- 143.13155858 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